ethyl (1R,6S)-1-(2-cyanoethyl)-4-(4-methoxyphenyl)-6-naphthalen-2-yl-2-oxidanylidene-cyclohex-3-ene-1-carboxylate

Systemtic Name: ethyl (1R,6S)-1-(2-cyanoethyl)-4-(4-methoxyphenyl)-6-naphthalen-2-yl-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl (1R,6S)-1-(2-cyanoethyl)-4-(4-methoxyphenyl)-6-(2-naphthyl)-2-oxo-cyclohex-3-ene-1-carboxylate CAS Name: (1R,6S)-1-(2-cyanoethyl)-4-(4-methoxyphenyl)-6-(2-naphthalenyl)-2-oxo-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl (1R,6S)-1-(2-cyanoethyl)-4-(4-methoxyphenyl)-6-naphthalen-2-yl-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: (1R,6S)-1-(2-cyanoethyl)-2-keto-4-(4-methoxyphenyl)-6-(2-naphthyl)cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C29H27NO4 MolecularWeight: 453.52898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(CC(=CC1=O)C2=CC=C(C=C2)OC)C3=CC4=CC=CC=C4C=C3)CCC#N

Isomeric SMILES

CCOC(=O)[C@@]1([C@@H](CC(=CC1=O)C2=CC=C(C=C2)OC)C3=CC4=CC=CC=C4C=C3)CCC#N

InChI

InChI=1S/C29H27NO4/c1-3-34-28(32)29(15-6-16-30)26(23-10-9-20-7-4-5-8-22(20)17-23)18-24(19-27(29)31)21-11-13-25(33-2)14-12-21/h4-5,7-14,17,19,26H,3,6,15,18H2,1-2H3/t26-,29+/m0/s1