methyl 2-[(4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl)amino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl 2-[(4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl)amino]-3-(1H-indol-3-yl)propanoate Openeye Name: methyl 2-[(4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl)amino]-3-(1H-indol-3-yl)propanoate CAS Name: 2-[(4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl)amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl 2-[(4,5-dimethoxy-3-oxo-1H-2-benzofuran-1-yl)amino]-3-(1H-indol-3-yl)propanoate Traditional Name: 3-(1H-indol-3-yl)-2-[(3-keto-4,5-dimethoxy-phthalan-1-yl)amino]propionic acid methyl ester Formula: C22H22N2O6 MolecularWeight: 410.41988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(OC2=O)NC(CC3=CNC4=CC=CC=C43)C(=O)OC)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C(OC2=O)NC(CC3=CNC4=CC=CC=C43)C(=O)OC)OC

InChI

InChI=1S/C22H22N2O6/c1-27-17-9-8-14-18(19(17)28-2)22(26)30-20(14)24-16(21(25)29-3)10-12-11-23-15-7-5-4-6-13(12)15/h4-9,11,16,20,23-24H,10H2,1-3H3