5-chloranyl-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-1H-indole-2-carboxamide

Systemtic Name: 5-chloranyl-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-1H-indole-2-carboxamide Openeye Name: 5-chloro-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-1H-indole-2-carboxamide CAS Name: 5-chloro-N-[[4-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]-1H-indole-2-carboxamide IUPAC Name: 5-chloro-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-1H-indole-2-carboxamide Traditional Name: 5-chloro-N-[4-(pyrrolidin-1-ium-1-ylmethyl)benzyl]-1H-indole-2-carboxamide Formula: C21H23ClN3O+ MolecularWeight: 368.87982

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=O)C3=CC4=C(N3)C=CC(=C4)Cl

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=O)C3=CC4=C(N3)C=CC(=C4)Cl

InChI

InChI=1S/C21H22ClN3O/c22-18-7-8-19-17(11-18)12-20(24-19)21(26)23-13-15-3-5-16(6-4-15)14-25-9-1-2-10-25/h3-8,11-12,24H,1-2,9-10,13-14H2,(H,23,26)/p+1