ethyl 6-[4-(diethylamino)phenyl]-4-(4-methoxyphenyl)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate

Systemtic Name: ethyl 6-[4-(diethylamino)phenyl]-4-(4-methoxyphenyl)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl 6-[4-(diethylamino)phenyl]-4-(4-methoxyphenyl)-2-oxo-cyclohex-3-ene-1-carboxylate CAS Name: 6-[4-(diethylamino)phenyl]-4-(4-methoxyphenyl)-2-oxo-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[4-(diethylamino)phenyl]-4-(4-methoxyphenyl)-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: 6-[4-(diethylamino)phenyl]-2-keto-4-(4-methoxyphenyl)cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C26H31NO4 MolecularWeight: 421.52864

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C2CC(=CC(=O)C2C(=O)OCC)C3=CC=C(C=C3)OC

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C2CC(=CC(=O)C2C(=O)OCC)C3=CC=C(C=C3)OC

InChI

InChI=1S/C26H31NO4/c1-5-27(6-2)21-12-8-19(9-13-21)23-16-20(18-10-14-22(30-4)15-11-18)17-24(28)25(23)26(29)31-7-3/h8-15,17,23,25H,5-7,16H2,1-4H3