[3-cyclopropyl-5-ethenyl-7-methyl-2-(4-oxidanylbutyl)-6,8-bis(oxidanylidene)isoquinolin-7-yl] furan-2-carboxylate

Systemtic Name: [3-cyclopropyl-5-ethenyl-7-methyl-2-(4-oxidanylbutyl)-6,8-bis(oxidanylidene)isoquinolin-7-yl] furan-2-carboxylate Openeye Name: [3-cyclopropyl-2-(4-hydroxybutyl)-7-methyl-6,8-dioxo-5-vinyl-7-isoquinolyl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [3-cyclopropyl-5-ethenyl-2-(4-hydroxybutyl)-7-methyl-6,8-dioxo-7-isoquinolinyl] ester IUPAC Name: [3-cyclopropyl-5-ethenyl-2-(4-hydroxybutyl)-7-methyl-6,8-dioxoisoquinolin-7-yl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [3-cyclopropyl-2-(4-hydroxybutyl)-6,8-diketo-7-methyl-5-vinyl-7-isoquinolyl] ester Formula: C24H25NO6 MolecularWeight: 423.4584

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C2=CN(C(=CC2=C(C1=O)C=C)C3CC3)CCCCO)OC(=O)C4=CC=CO4

Isomeric SMILES

CC1(C(=O)C2=CN(C(=CC2=C(C1=O)C=C)C3CC3)CCCCO)OC(=O)C4=CC=CO4

InChI

InChI=1S/C24H25NO6/c1-3-16-17-13-19(15-8-9-15)25(10-4-5-11-26)14-18(17)22(28)24(2,21(16)27)31-23(29)20-7-6-12-30-20/h3,6-7,12-15,26H,1,4-5,8-11H2,2H3