[amino (4-{(3as,4R,8as,8br)-1,3-dioxo-2- [3-(trimethylammonio) propyl]decahydropyrrolo[3,4-a] pyrrolizin-4-yl}phenyl) methylene]ammonium (Q27456677)

2bok (English)

19 October 2016

C₂₂H₃₂N₅O₂⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

C[N+](C)(C)CCCN1C(=O)C2C3CCCN3C(C2C1=O)C4=CC=C(C=C4)C(=N)N

1 reference

2bok (English)

19 October 2016

C[N+](C)(C)CCCN1C(=O)[C@H]2[C@@H]3CCCN3[C@H]([C@H]2C1=O)C4=CC=C(C=C4)C(=N)N

1 reference

InChI=1S/C22H32N5O2/c1-27(2,3)13-5-12-26-21(28)17-16-6-4-11-25(16)19(18(17)22(26)29)14-7-9-15(10-8-14)20(23)24/h7-10,16-19H,4-6,11-13H2,1-3H3,(H3,23,24)/q+1/t16-,17-,18-,19-/m0/s1

2bok (English)

retrieved

19 October 2016

Identifiers

InChI

1 reference

JCLUABDCGDTVPA-VJANTYMQSA-N

2bok (English)

19 October 2016

1 reference

2bok (English)

19 October 2016

1 reference

3-[(3aS,4R,8aS,8bR)-4-(4-Carbamimidoylphenyl)-1,3-dioxooctahydropyrrolo[3,4-a]pyrrolizin-2(3H)-yl]-N,N,N-trimethyl-1-propanaminium (English)

19 October 2016

2 references

matched by identifier from

2bok (English)

retrieved

19 October 2016

InChIKey

JCLUABDCGDTVPA-VJANTYMQSA-N

1 reference

0 references

1 reference