ethyl 4-[[(3S)-5-oxidanylidene-3-phenyl-cyclohexen-1-yl]amino]benzoate

Systemtic Name: ethyl 4-[[(3S)-5-oxidanylidene-3-phenyl-cyclohexen-1-yl]amino]benzoate Openeye Name: ethyl 4-[[(3S)-5-oxo-3-phenyl-cyclohexen-1-yl]amino]benzoate CAS Name: 4-[[(3S)-5-oxo-3-phenyl-1-cyclohexenyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(3S)-5-oxo-3-phenylcyclohexen-1-yl]amino]benzoate Traditional Name: 4-[[(3S)-5-keto-3-phenyl-cyclohexen-1-yl]amino]benzoic acid ethyl ester Formula: C21H21NO3 MolecularWeight: 335.39634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC2=CC(CC(=O)C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC2=C[C@H](CC(=O)C2)C3=CC=CC=C3

InChI

InChI=1S/C21H21NO3/c1-2-25-21(24)16-8-10-18(11-9-16)22-19-12-17(13-20(23)14-19)15-6-4-3-5-7-15/h3-12,17,22H,2,13-14H2,1H3/t17-/m1/s1