1-[4-(1-cyclohexylethylcarbamoyl)-2-phenyl-quinolin-3-yl]-N,N-dimethyl-methanamine oxide

Systemtic Name: 1-[4-(1-cyclohexylethylcarbamoyl)-2-phenyl-quinolin-3-yl]-N,N-dimethyl-methanamine oxide Openeye Name: 1-[4-(1-cyclohexylethylcarbamoyl)-2-phenyl-3-quinolyl]-N,N-dimethyl-methanamine oxide CAS Name: 1-[4-[(1-cyclohexylethylamino)-oxomethyl]-2-phenyl-3-quinolinyl]-N,N-dimethylmethanamine oxide IUPAC Name: 1-[4-(1-cyclohexylethylcarbamoyl)-2-phenylquinolin-3-yl]-N,N-dimethylmethanamine oxide Traditional Name: 1-[4-(1-cyclohexylethylcarbamoyl)-2-phenyl-3-quinolyl]-N,N-dimethyl-methanamine oxide Formula: C27H33N3O2 MolecularWeight: 431.56982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCCC1)NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=CC=C4)C[N+](C)(C)[O-]

Isomeric SMILES

CC(C1CCCCC1)NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=CC=C4)C[N+](C)(C)[O-]

InChI

InChI=1S/C27H33N3O2/c1-19(20-12-6-4-7-13-20)28-27(31)25-22-16-10-11-17-24(22)29-26(21-14-8-5-9-15-21)23(25)18-30(2,3)32/h5,8-11,14-17,19-20H,4,6-7,12-13,18H2,1-3H3,(H,28,31)