[(2S)-1-[(4-ethylphenyl)amino]-1-oxidanylidene-propan-2-yl]-(phenylmethyl)azanium

Systemtic Name: [(2S)-1-[(4-ethylphenyl)amino]-1-oxidanylidene-propan-2-yl]-(phenylmethyl)azanium Openeye Name: benzyl-[(1S)-2-(4-ethylanilino)-1-methyl-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-(4-ethylanilino)-1-oxopropan-2-yl]-(phenylmethyl)ammonium IUPAC Name: benzyl-[(2S)-1-(4-ethylanilino)-1-oxopropan-2-yl]azanium Traditional Name: benzyl-[(1S)-2-(4-ethylanilino)-2-keto-1-methyl-ethyl]ammonium Formula: C18H23N2O+ MolecularWeight: 283.38802

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(C)[NH2+]CC2=CC=CC=C2

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)[C@H](C)[NH2+]CC2=CC=CC=C2

InChI

InChI=1S/C18H22N2O/c1-3-15-9-11-17(12-10-15)20-18(21)14(2)19-13-16-7-5-4-6-8-16/h4-12,14,19H,3,13H2,1-2H3,(H,20,21)/p+1/t14-/m0/s1