ethyl 2,5-bis(oxidanylidene)-7-(4-propan-2-ylphenyl)-1,6,7,8-tetrahydroquinoline-3-carboxylate

Systemtic Name: ethyl 2,5-bis(oxidanylidene)-7-(4-propan-2-ylphenyl)-1,6,7,8-tetrahydroquinoline-3-carboxylate Openeye Name: ethyl 7-(4-isopropylphenyl)-2,5-dioxo-1,6,7,8-tetrahydroquinoline-3-carboxylate CAS Name: 2,5-dioxo-7-(4-propan-2-ylphenyl)-1,6,7,8-tetrahydroquinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dioxo-7-(4-propan-2-ylphenyl)-1,6,7,8-tetrahydroquinoline-3-carboxylate Traditional Name: 2,5-diketo-7-p-cumenyl-1,6,7,8-tetrahydroquinoline-3-carboxylic acid ethyl ester Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(CC(CC2=O)C3=CC=C(C=C3)C(C)C)NC1=O

Isomeric SMILES

CCOC(=O)C1=CC2=C(CC(CC2=O)C3=CC=C(C=C3)C(C)C)NC1=O

InChI

InChI=1S/C21H23NO4/c1-4-26-21(25)17-11-16-18(22-20(17)24)9-15(10-19(16)23)14-7-5-13(6-8-14)12(2)3/h5-8,11-12,15H,4,9-10H2,1-3H3,(H,22,24)