ethyl (1S,6S)-4-[(E)-2-(4-dimethylaminophenyl)ethenyl]-2-oxidanylidene-6-phenyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: ethyl (1S,6S)-4-[(E)-2-(4-dimethylaminophenyl)ethenyl]-2-oxidanylidene-6-phenyl-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl (1S,6S)-4-[(E)-2-(4-dimethylaminophenyl)vinyl]-2-oxo-6-phenyl-cyclohex-3-ene-1-carboxylate CAS Name: (1S,6S)-4-[(E)-2-(4-dimethylaminophenyl)ethenyl]-2-oxo-6-phenyl-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,6S)-4-[(E)-2-(4-dimethylaminophenyl)ethenyl]-2-oxo-6-phenylcyclohex-3-ene-1-carboxylate Traditional Name: (1S,6S)-4-[(E)-2-(4-dimethylaminophenyl)vinyl]-2-keto-6-phenyl-cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C25H27NO3 MolecularWeight: 389.48678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CC(=CC1=O)C=CC2=CC=C(C=C2)N(C)C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@H]1[C@H](CC(=CC1=O)/C=C/C2=CC=C(C=C2)N(C)C)C3=CC=CC=C3

InChI

InChI=1S/C25H27NO3/c1-4-29-25(28)24-22(20-8-6-5-7-9-20)16-19(17-23(24)27)11-10-18-12-14-21(15-13-18)26(2)3/h5-15,17,22,24H,4,16H2,1-3H3/b11-10+/t22-,24+/m1/s1