phenethyl 1-(4-ethoxyphenyl)-7,7-dimethyl-2,5-bis(oxidanylidene)-6,8-dihydroquinoline-3-carboxylate

Systemtic Name: phenethyl 1-(4-ethoxyphenyl)-7,7-dimethyl-2,5-bis(oxidanylidene)-6,8-dihydroquinoline-3-carboxylate Openeye Name: phenethyl 1-(4-ethoxyphenyl)-7,7-dimethyl-2,5-dioxo-6,8-dihydroquinoline-3-carboxylate CAS Name: 1-(4-ethoxyphenyl)-7,7-dimethyl-2,5-dioxo-6,8-dihydroquinoline-3-carboxylic acid phenethyl ester IUPAC Name: phenethyl 1-(4-ethoxyphenyl)-7,7-dimethyl-2,5-dioxo-6,8-dihydroquinoline-3-carboxylate Traditional Name: 2,5-diketo-7,7-dimethyl-1-p-phenetyl-6,8-dihydroquinoline-3-carboxylic acid phenethyl ester Formula: C28H29NO5 MolecularWeight: 459.53356

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C3=C(C=C(C2=O)C(=O)OCCC4=CC=CC=C4)C(=O)CC(C3)(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C3=C(C=C(C2=O)C(=O)OCCC4=CC=CC=C4)C(=O)CC(C3)(C)C

InChI

InChI=1S/C28H29NO5/c1-4-33-21-12-10-20(11-13-21)29-24-17-28(2,3)18-25(30)22(24)16-23(26(29)31)27(32)34-15-14-19-8-6-5-7-9-19/h5-13,16H,4,14-15,17-18H2,1-3H3