ethyl 1-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-6,7-dimethoxy-isoquinoline-4-carboxylate

Systemtic Name: ethyl 1-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-6,7-dimethoxy-isoquinoline-4-carboxylate Openeye Name: ethyl 1-[(1,3-dioxoisoindolin-2-yl)methyl]-6,7-dimethoxy-isoquinoline-4-carboxylate CAS Name: 1-[(1,3-dioxo-2-isoindolyl)methyl]-6,7-dimethoxy-4-isoquinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(1,3-dioxoisoindol-2-yl)methyl]-6,7-dimethoxyisoquinoline-4-carboxylate Traditional Name: 6,7-dimethoxy-1-(phthalimidomethyl)isoquinoline-4-carboxylic acid ethyl ester Formula: C23H20N2O6 MolecularWeight: 420.4147

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(C2=CC(=C(C=C21)OC)OC)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCOC(=O)C1=CN=C(C2=CC(=C(C=C21)OC)OC)CN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H20N2O6/c1-4-31-23(28)17-11-24-18(16-10-20(30-3)19(29-2)9-15(16)17)12-25-21(26)13-7-5-6-8-14(13)22(25)27/h5-11H,4,12H2,1-3H3