tcv-309 cation (Q27290617)

UNII-U32W2WAF3L (English)

14 October 2016

chemical formula

C₃₀H₃₄BrN₄O₄⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CCC[N+]1=CC(=CC(=C1)Br)C(=O)N(CCC(=O)NCCOC(=O)N2CCC3=CC=CC=C3C2)C4=CC=CC=C4

1 reference

UNII-U32W2WAF3L (English)

InChI=1S/C30H33BrN4O4/c1-2-15-33-20-25(19-26(31)22-33)29(37)35(27-10-4-3-5-11-27)17-13-28(36)32-14-18-39-30(38)34-16-12-23-8-6-7-9-24(23)21-34/h3-11,19-20,22H,2,12-18,21H2,1H3/p+1

14 October 2016

Identifiers

InChI

1 reference

UNII-U32W2WAF3L (English)

NWWZMECSQFUIGC-UHFFFAOYSA-O

14 October 2016

InChIKey

1 reference

Global Substance Registration System

UNII-U32W2WAF3L (English)

14 October 2016

1 reference

UNII

U32W2WAF3L

tcv-309 cation (English)

14 October 2016

1 reference

3-Bromo-5-{[3-({2-[(3,4-dihydro-2(1H)-isoquinolinylcarbonyl)oxy]ethyl}amino)-3-oxopropyl](phenyl)carbamoyl}-1-propylpyridinium (English)

14 October 2016

2 references

UNII-U32W2WAF3L (English)

matched by identifier from

14 October 2016

InChIKey

NWWZMECSQFUIGC-UHFFFAOYSA-O

1 reference

2 references

Global Substance Registration System

UNII

U32W2WAF3L

tcv-309 cation (English)