ethyl (1S,6S)-6-(2-ethoxyphenyl)-4-(4-methoxyphenyl)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate

Systemtic Name: ethyl (1S,6S)-6-(2-ethoxyphenyl)-4-(4-methoxyphenyl)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl (1S,6S)-6-(2-ethoxyphenyl)-4-(4-methoxyphenyl)-2-oxo-cyclohex-3-ene-1-carboxylate CAS Name: (1S,6S)-6-(2-ethoxyphenyl)-4-(4-methoxyphenyl)-2-oxo-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,6S)-6-(2-ethoxyphenyl)-4-(4-methoxyphenyl)-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: (1S,6S)-2-keto-4-(4-methoxyphenyl)-6-o-phenetyl-cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C24H26O5 MolecularWeight: 394.46024

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2CC(=CC(=O)C2C(=O)OCC)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC1=CC=CC=C1[C@H]2CC(=CC(=O)[C@H]2C(=O)OCC)C3=CC=C(C=C3)OC

InChI

InChI=1S/C24H26O5/c1-4-28-22-9-7-6-8-19(22)20-14-17(16-10-12-18(27-3)13-11-16)15-21(25)23(20)24(26)29-5-2/h6-13,15,20,23H,4-5,14H2,1-3H3/t20-,23+/m1/s1