2-(1H-benzimidazol-2-yl)ethyl-[(7-methyl-2-oxidanylidene-1-phenethyl-quinolin-3-yl)methyl]azanium

Systemtic Name: 2-(1H-benzimidazol-2-yl)ethyl-[(7-methyl-2-oxidanylidene-1-phenethyl-quinolin-3-yl)methyl]azanium Openeye Name: 2-(1H-benzimidazol-2-yl)ethyl-[(7-methyl-2-oxo-1-phenethyl-3-quinolyl)methyl]ammonium CAS Name: 2-(1H-benzimidazol-2-yl)ethyl-[(7-methyl-2-oxo-1-phenethyl-3-quinolinyl)methyl]ammonium IUPAC Name: 2-(1H-benzimidazol-2-yl)ethyl-[(7-methyl-2-oxo-1-phenethylquinolin-3-yl)methyl]azanium Traditional Name: 2-(1H-benzimidazol-2-yl)ethyl-[(2-keto-7-methyl-1-phenethyl-3-quinolyl)methyl]ammonium Formula: C28H29N4O+ MolecularWeight: 437.55606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=O)N2CCC3=CC=CC=C3)C[NH2+]CCC4=NC5=CC=CC=C5N4

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=O)N2CCC3=CC=CC=C3)C[NH2+]CCC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C28H28N4O/c1-20-11-12-22-18-23(19-29-15-13-27-30-24-9-5-6-10-25(24)31-27)28(33)32(26(22)17-20)16-14-21-7-3-2-4-8-21/h2-12,17-18,29H,13-16,19H2,1H3,(H,30,31)/p+1