(5S)-5-(3,4-dimethoxyphenyl)-3-[(2-methylphenyl)amino]cyclohex-3-en-1-one

Systemtic Name: (5S)-5-(3,4-dimethoxyphenyl)-3-[(2-methylphenyl)amino]cyclohex-3-en-1-one Openeye Name: (5S)-5-(3,4-dimethoxyphenyl)-3-(2-methylanilino)cyclohex-3-en-1-one CAS Name: (5S)-5-(3,4-dimethoxyphenyl)-3-(2-methylanilino)-1-cyclohex-3-enone IUPAC Name: (5S)-5-(3,4-dimethoxyphenyl)-3-(2-methylanilino)cyclohex-3-en-1-one Traditional Name: (5S)-5-(3,4-dimethoxyphenyl)-3-(o-toluidino)cyclohex-3-en-1-one Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=CC(CC(=O)C2)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=CC=C1NC2=C[C@H](CC(=O)C2)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H23NO3/c1-14-6-4-5-7-19(14)22-17-10-16(11-18(23)13-17)15-8-9-20(24-2)21(12-15)25-3/h4-10,12,16,22H,11,13H2,1-3H3/t16-/m1/s1