[(1S)-2-[(3-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-(phenylmethyl)azanium

Systemtic Name: [(1S)-2-[(3-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-(phenylmethyl)azanium Openeye Name: benzyl-[(1S)-2-(3-chloro-4-methyl-anilino)-2-oxo-1-phenyl-ethyl]ammonium CAS Name: [(1S)-2-(3-chloro-4-methylanilino)-2-oxo-1-phenylethyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-[(1S)-2-(3-chloro-4-methylanilino)-2-oxo-1-phenylethyl]azanium Traditional Name: benzyl-[(1S)-2-(3-chloro-4-methyl-anilino)-2-keto-1-phenyl-ethyl]ammonium Formula: C22H22ClN2O+ MolecularWeight: 365.87588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C2=CC=CC=C2)[NH2+]CC3=CC=CC=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)[C@H](C2=CC=CC=C2)[NH2+]CC3=CC=CC=C3)Cl

InChI

InChI=1S/C22H21ClN2O/c1-16-12-13-19(14-20(16)23)25-22(26)21(18-10-6-3-7-11-18)24-15-17-8-4-2-5-9-17/h2-14,21,24H,15H2,1H3,(H,25,26)/p+1/t21-/m0/s1