(3S)-N-[[4-(benzimidazol-1-yl)phenyl]methyl]-1-(phenylmethyl)pyrrolidin-1-ium-3-amine

Systemtic Name: (3S)-N-[[4-(benzimidazol-1-yl)phenyl]methyl]-1-(phenylmethyl)pyrrolidin-1-ium-3-amine Openeye Name: (3S)-N-[[4-(benzimidazol-1-yl)phenyl]methyl]-1-benzyl-pyrrolidin-1-ium-3-amine CAS Name: (3S)-N-[[4-(1-benzimidazolyl)phenyl]methyl]-1-(phenylmethyl)-3-pyrrolidin-1-iumamine IUPAC Name: (3S)-N-[[4-(benzimidazol-1-yl)phenyl]methyl]-1-benzylpyrrolidin-1-ium-3-amine Traditional Name: [4-(benzimidazol-1-yl)benzyl]-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]amine Formula: C25H27N4+ MolecularWeight: 383.50868

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC1NCC2=CC=C(C=C2)N3C=NC4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

C1C[NH+](C[C@H]1NCC2=CC=C(C=C2)N3C=NC4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C25H26N4/c1-2-6-21(7-3-1)17-28-15-14-22(18-28)26-16-20-10-12-23(13-11-20)29-19-27-24-8-4-5-9-25(24)29/h1-13,19,22,26H,14-18H2/p+1/t22-/m0/s1