[3-butyl-2-(4-methoxyphenyl)-7-methyl-6,8-bis(oxidanylidene)isoquinolin-7-yl] propanoate

Systemtic Name: [3-butyl-2-(4-methoxyphenyl)-7-methyl-6,8-bis(oxidanylidene)isoquinolin-7-yl] propanoate Openeye Name: [3-butyl-2-(4-methoxyphenyl)-7-methyl-6,8-dioxo-7-isoquinolyl] propanoate CAS Name: propanoic acid [3-butyl-2-(4-methoxyphenyl)-7-methyl-6,8-dioxo-7-isoquinolinyl] ester IUPAC Name: [3-butyl-2-(4-methoxyphenyl)-7-methyl-6,8-dioxoisoquinolin-7-yl] propanoate Traditional Name: propionic acid [3-butyl-6,8-diketo-2-(4-methoxyphenyl)-7-methyl-7-isoquinolyl] ester Formula: C24H27NO5 MolecularWeight: 409.47488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=CC(=O)C(C(=O)C2=CN1C3=CC=C(C=C3)OC)(C)OC(=O)CC

Isomeric SMILES

CCCCC1=CC2=CC(=O)C(C(=O)C2=CN1C3=CC=C(C=C3)OC)(C)OC(=O)CC

InChI

InChI=1S/C24H27NO5/c1-5-7-8-18-13-16-14-21(26)24(3,30-22(27)6-2)23(28)20(16)15-25(18)17-9-11-19(29-4)12-10-17/h9-15H,5-8H2,1-4H3