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

Systemtic Name: [2-cyclopentyl-3-cyclopropyl-5-ethenyl-7-methyl-6,8-bis(oxidanylidene)isoquinolin-7-yl] furan-2-carboxylate Openeye Name: (2-cyclopentyl-3-cyclopropyl-7-methyl-6,8-dioxo-5-vinyl-7-isoquinolyl) furan-2-carboxylate CAS Name: 2-furancarboxylic acid (2-cyclopentyl-3-cyclopropyl-5-ethenyl-7-methyl-6,8-dioxo-7-isoquinolinyl) ester IUPAC Name: (2-cyclopentyl-3-cyclopropyl-5-ethenyl-7-methyl-6,8-dioxoisoquinolin-7-yl) furan-2-carboxylate Traditional Name: furan-2-carboxylic acid (2-cyclopentyl-3-cyclopropyl-6,8-diketo-7-methyl-5-vinyl-7-isoquinolyl) ester Formula: C25H25NO5 MolecularWeight: 419.4697

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C2=CN(C(=CC2=C(C1=O)C=C)C3CC3)C4CCCC4)OC(=O)C5=CC=CO5

Isomeric SMILES

CC1(C(=O)C2=CN(C(=CC2=C(C1=O)C=C)C3CC3)C4CCCC4)OC(=O)C5=CC=CO5

InChI

InChI=1S/C25H25NO5/c1-3-17-18-13-20(15-10-11-15)26(16-7-4-5-8-16)14-19(18)23(28)25(2,22(17)27)31-24(29)21-9-6-12-30-21/h3,6,9,12-16H,1,4-5,7-8,10-11H2,2H3