[3-[3-azanylpropyl(methyl)amino]-3-phenyl-benzimidazol-3-ium-4-yl] carbamate

Systemtic Name: [3-[3-azanylpropyl(methyl)amino]-3-phenyl-benzimidazol-3-ium-4-yl] carbamate Openeye Name: [3-[3-aminopropyl(methyl)amino]-3-phenyl-benzimidazol-3-ium-4-yl] carbamate CAS Name: carbamic acid [3-[3-aminopropyl(methyl)amino]-3-phenyl-4-benzimidazol-3-iumyl] ester IUPAC Name: [3-[3-aminopropyl(methyl)amino]-3-phenylbenzimidazol-3-ium-4-yl] carbamate Traditional Name: carbamic acid [3-[3-aminopropyl(methyl)amino]-3-phenyl-benzimidazol-3-ium-4-yl] ester Formula: C18H22N5O2+ MolecularWeight: 340.39958

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCN)[N+]1(C=NC2=C1C(=CC=C2)OC(=O)N)C3=CC=CC=C3

Isomeric SMILES

CN(CCCN)[N+]1(C=NC2=C1C(=CC=C2)OC(=O)N)C3=CC=CC=C3

InChI

InChI=1S/C18H21N5O2/c1-22(12-6-11-19)23(14-7-3-2-4-8-14)13-21-15-9-5-10-16(17(15)23)25-18(20)24/h2-5,7-10,13H,6,11-12,19H2,1H3,(H-,20,24)/p+1