(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)methyl-[(1R)-1-phenylethyl]azanium

Systemtic Name: (1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)methyl-[(1R)-1-phenylethyl]azanium Openeye Name: (1,3-dimethyl-2-oxo-benzimidazol-5-yl)methyl-[(1R)-1-phenylethyl]ammonium CAS Name: (1,3-dimethyl-2-oxo-5-benzimidazolyl)methyl-[(1R)-1-phenylethyl]ammonium IUPAC Name: (1,3-dimethyl-2-oxobenzimidazol-5-yl)methyl-[(1R)-1-phenylethyl]azanium Traditional Name: (2-keto-1,3-dimethyl-benzimidazol-5-yl)methyl-[(1R)-1-phenylethyl]ammonium Formula: C18H22N3O+ MolecularWeight: 296.38678

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[NH2+]CC2=CC3=C(C=C2)N(C(=O)N3C)C

Isomeric SMILES

C[C@H](C1=CC=CC=C1)[NH2+]CC2=CC3=C(C=C2)N(C(=O)N3C)C

InChI

InChI=1S/C18H21N3O/c1-13(15-7-5-4-6-8-15)19-12-14-9-10-16-17(11-14)21(3)18(22)20(16)2/h4-11,13,19H,12H2,1-3H3/p+1/t13-/m1/s1