methyl 3-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoylamino]-5-methoxy-1-benzofuran-2-carboxylate

Systemtic Name: methyl 3-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoylamino]-5-methoxy-1-benzofuran-2-carboxylate Openeye Name: methyl 3-[4-(1,3-dioxoisoindolin-2-yl)butanoylamino]-5-methoxy-benzofuran-2-carboxylate CAS Name: 3-[[4-(1,3-dioxo-2-isoindolyl)-1-oxobutyl]amino]-5-methoxy-2-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 3-[4-(1,3-dioxoisoindol-2-yl)butanoylamino]-5-methoxy-1-benzofuran-2-carboxylate Traditional Name: 5-methoxy-3-(4-phthalimidobutanoylamino)coumarilic acid methyl ester Formula: C23H20N2O7 MolecularWeight: 436.4141

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OC(=C2NC(=O)CCCN3C(=O)C4=CC=CC=C4C3=O)C(=O)OC

Isomeric SMILES

COC1=CC2=C(C=C1)OC(=C2NC(=O)CCCN3C(=O)C4=CC=CC=C4C3=O)C(=O)OC

InChI

InChI=1S/C23H20N2O7/c1-30-13-9-10-17-16(12-13)19(20(32-17)23(29)31-2)24-18(26)8-5-11-25-21(27)14-6-3-4-7-15(14)22(25)28/h3-4,6-7,9-10,12H,5,8,11H2,1-2H3,(H,24,26)