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

Systemtic Name: O4-[3-cyclopropyl-2-(cyclopropylmethyl)-7-methyl-6,8-bis(oxidanylidene)isoquinolin-7-yl] O1-methyl butanedioate Openeye Name: O4-[3-cyclopropyl-2-(cyclopropylmethyl)-7-methyl-6,8-dioxo-7-isoquinolyl] O1-methyl butanedioate CAS Name: butanedioic acid O4-[3-cyclopropyl-2-(cyclopropylmethyl)-7-methyl-6,8-dioxo-7-isoquinolinyl] ester O1-methyl ester IUPAC Name: 4-O-[3-cyclopropyl-2-(cyclopropylmethyl)-7-methyl-6,8-dioxoisoquinolin-7-yl] 1-O-methyl butanedioate Traditional Name: succinic acid O4-[3-cyclopropyl-2-(cyclopropylmethyl)-6,8-diketo-7-methyl-7-isoquinolyl] ester O1-methyl ester Formula: C22H25NO6 MolecularWeight: 399.437

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C=C2C=C(N(C=C2C1=O)CC3CC3)C4CC4)OC(=O)CCC(=O)OC

Isomeric SMILES

CC1(C(=O)C=C2C=C(N(C=C2C1=O)CC3CC3)C4CC4)OC(=O)CCC(=O)OC

InChI

InChI=1S/C22H25NO6/c1-22(29-20(26)8-7-19(25)28-2)18(24)10-15-9-17(14-5-6-14)23(11-13-3-4-13)12-16(15)21(22)27/h9-10,12-14H,3-8,11H2,1-2H3