[4-[3-cyano-7-(4-methoxyphenyl)-2-methyl-5-oxidanylidene-4,4a,6,7-tetrahydro-1H-quinolin-4-yl]-2-methoxy-phenyl] ethanoate

Systemtic Name: [4-[3-cyano-7-(4-methoxyphenyl)-2-methyl-5-oxidanylidene-4,4a,6,7-tetrahydro-1H-quinolin-4-yl]-2-methoxy-phenyl] ethanoate Openeye Name: [4-[3-cyano-7-(4-methoxyphenyl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-1H-quinolin-4-yl]-2-methoxy-phenyl] acetate CAS Name: acetic acid [4-[3-cyano-7-(4-methoxyphenyl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-1H-quinolin-4-yl]-2-methoxyphenyl] ester IUPAC Name: [4-[3-cyano-7-(4-methoxyphenyl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-1H-quinolin-4-yl]-2-methoxyphenyl] acetate Traditional Name: acetic acid [4-[3-cyano-5-keto-7-(4-methoxyphenyl)-2-methyl-4,4a,6,7-tetrahydro-1H-quinolin-4-yl]-2-methoxy-phenyl] ester Formula: C27H26N2O5 MolecularWeight: 458.50574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2C(=O)CC(C=C2N1)C3=CC=C(C=C3)OC)C4=CC(=C(C=C4)OC(=O)C)OC)C#N

Isomeric SMILES

CC1=C(C(C2C(=O)CC(C=C2N1)C3=CC=C(C=C3)OC)C4=CC(=C(C=C4)OC(=O)C)OC)C#N

InChI

InChI=1S/C27H26N2O5/c1-15-21(14-28)26(18-7-10-24(34-16(2)30)25(13-18)33-4)27-22(29-15)11-19(12-23(27)31)17-5-8-20(32-3)9-6-17/h5-11,13,19,26-27,29H,12H2,1-4H3