O4-[5-bromanyl-2,3-bis(4-methoxyphenyl)-7-methyl-6,8-bis(oxidanylidene)isoquinolin-7-yl] O1-methyl butanedioate

Systemtic Name: O4-[5-bromanyl-2,3-bis(4-methoxyphenyl)-7-methyl-6,8-bis(oxidanylidene)isoquinolin-7-yl] O1-methyl butanedioate Openeye Name: O4-[5-bromo-2,3-bis(4-methoxyphenyl)-7-methyl-6,8-dioxo-7-isoquinolyl] O1-methyl butanedioate CAS Name: butanedioic acid O4-[5-bromo-2,3-bis(4-methoxyphenyl)-7-methyl-6,8-dioxo-7-isoquinolinyl] ester O1-methyl ester IUPAC Name: 4-O-[5-bromo-2,3-bis(4-methoxyphenyl)-7-methyl-6,8-dioxoisoquinolin-7-yl] 1-O-methyl butanedioate Traditional Name: succinic acid O4-[5-bromo-6,8-diketo-2,3-bis(4-methoxyphenyl)-7-methyl-7-isoquinolyl] ester O1-methyl ester Formula: C29H26BrNO8 MolecularWeight: 596.42264

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C2=CN(C(=CC2=C(C1=O)Br)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC)OC(=O)CCC(=O)OC

Isomeric SMILES

CC1(C(=O)C2=CN(C(=CC2=C(C1=O)Br)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC)OC(=O)CCC(=O)OC

InChI

InChI=1S/C29H26BrNO8/c1-29(39-25(33)14-13-24(32)38-4)27(34)22-16-31(18-7-11-20(37-3)12-8-18)23(15-21(22)26(30)28(29)35)17-5-9-19(36-2)10-6-17/h5-12,15-16H,13-14H2,1-4H3