O4-[2,3-dicyclopropyl-7-methyl-6,8-bis(oxidanylidene)isoquinolin-7-yl] O1-methyl butanedioate

Systemtic Name: O4-[2,3-dicyclopropyl-7-methyl-6,8-bis(oxidanylidene)isoquinolin-7-yl] O1-methyl butanedioate Openeye Name: O4-(2,3-dicyclopropyl-7-methyl-6,8-dioxo-7-isoquinolyl) O1-methyl butanedioate CAS Name: butanedioic acid O4-(2,3-dicyclopropyl-7-methyl-6,8-dioxo-7-isoquinolinyl) ester O1-methyl ester IUPAC Name: 4-O-(2,3-dicyclopropyl-7-methyl-6,8-dioxoisoquinolin-7-yl) 1-O-methyl butanedioate Traditional Name: succinic acid O4-(2,3-dicyclopropyl-6,8-diketo-7-methyl-7-isoquinolyl) ester O1-methyl ester Formula: C21H23NO6 MolecularWeight: 385.41042

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C=C2C=C(N(C=C2C1=O)C3CC3)C4CC4)OC(=O)CCC(=O)OC

Isomeric SMILES

CC1(C(=O)C=C2C=C(N(C=C2C1=O)C3CC3)C4CC4)OC(=O)CCC(=O)OC

InChI

InChI=1S/C21H23NO6/c1-21(28-19(25)8-7-18(24)27-2)17(23)10-13-9-16(12-3-4-12)22(14-5-6-14)11-15(13)20(21)26/h9-12,14H,3-8H2,1-2H3