(2S)-2-(3-chlorophenyl)-2-[(3,4-dimethylphenyl)amino]ethanoate

Systemtic Name: (2S)-2-(3-chlorophenyl)-2-[(3,4-dimethylphenyl)amino]ethanoate Openeye Name: (2S)-2-(3-chlorophenyl)-2-(3,4-dimethylanilino)acetate CAS Name: (2S)-2-(3-chlorophenyl)-2-(3,4-dimethylanilino)acetate IUPAC Name: (2S)-2-(3-chlorophenyl)-2-(3,4-dimethylanilino)acetate Traditional Name: (2S)-2-(3-chlorophenyl)-2-(3,4-dimethylanilino)acetate Formula: C16H15ClNO2- MolecularWeight: 288.7488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(C2=CC(=CC=C2)Cl)C(=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)N[C@@H](C2=CC(=CC=C2)Cl)C(=O)[O-])C

InChI

InChI=1S/C16H16ClNO2/c1-10-6-7-14(8-11(10)2)18-15(16(19)20)12-4-3-5-13(17)9-12/h3-9,15,18H,1-2H3,(H,19,20)/p-1/t15-/m0/s1