[(1S)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl]-[(4-ethylphenyl)methyl]-methyl-azanium

Systemtic Name: [(1S)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl]-[(4-ethylphenyl)methyl]-methyl-azanium Openeye Name: [(1S)-2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl]-[(4-ethylphenyl)methyl]-methyl-ammonium CAS Name: [(1S)-2-(cyclopropylamino)-2-oxo-1-phenylethyl]-[(4-ethylphenyl)methyl]-methylammonium IUPAC Name: [(1S)-2-(cyclopropylamino)-2-oxo-1-phenylethyl]-[(4-ethylphenyl)methyl]-methylazanium Traditional Name: [(1S)-2-(cyclopropylamino)-2-keto-1-phenyl-ethyl]-(4-ethylbenzyl)-methyl-ammonium Formula: C21H27N2O+ MolecularWeight: 323.45188

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+](C)C(C2=CC=CC=C2)C(=O)NC3CC3

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+](C)[C@@H](C2=CC=CC=C2)C(=O)NC3CC3

InChI

InChI=1S/C21H26N2O/c1-3-16-9-11-17(12-10-16)15-23(2)20(18-7-5-4-6-8-18)21(24)22-19-13-14-19/h4-12,19-20H,3,13-15H2,1-2H3,(H,22,24)/p+1/t20-/m0/s1