[(1S)-2-[(4-methylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-propyl-azanium

Systemtic Name: [(1S)-2-[(4-methylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-propyl-azanium Openeye Name: [(1S)-2-(4-methylanilino)-2-oxo-1-phenyl-ethyl]-propyl-ammonium CAS Name: [(1S)-2-(4-methylanilino)-2-oxo-1-phenylethyl]-propylammonium IUPAC Name: [(1S)-2-(4-methylanilino)-2-oxo-1-phenylethyl]-propylazanium Traditional Name: [(1S)-2-keto-1-phenyl-2-(p-toluidino)ethyl]-propyl-ammonium Formula: C18H23N2O+ MolecularWeight: 283.38802

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH2+]C(C1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)C

Isomeric SMILES

CCC[NH2+][C@@H](C1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)C

InChI

InChI=1S/C18H22N2O/c1-3-13-19-17(15-7-5-4-6-8-15)18(21)20-16-11-9-14(2)10-12-16/h4-12,17,19H,3,13H2,1-2H3,(H,20,21)/p+1/t17-/m0/s1