[4-(4-methoxyphenyl)-2-oxidanylidene-chromen-7-yl] 3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: [4-(4-methoxyphenyl)-2-oxidanylidene-chromen-7-yl] 3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: [4-(4-methoxyphenyl)-2-oxo-chromen-7-yl] 2-(benzyloxycarbonylamino)-3-(1H-indol-3-yl)propanoate CAS Name: 3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoic acid [4-(4-methoxyphenyl)-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [4-(4-methoxyphenyl)-2-oxochromen-7-yl] 3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-(1H-indol-3-yl)propionic acid [2-keto-4-(4-methoxyphenyl)chromen-7-yl] ester Formula: C35H28N2O7 MolecularWeight: 588.60602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=O)OC3=C2C=CC(=C3)OC(=O)C(CC4=CNC5=CC=CC=C54)NC(=O)OCC6=CC=CC=C6

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=O)OC3=C2C=CC(=C3)OC(=O)C(CC4=CNC5=CC=CC=C54)NC(=O)OCC6=CC=CC=C6

InChI

InChI=1S/C35H28N2O7/c1-41-25-13-11-23(12-14-25)29-19-33(38)44-32-18-26(15-16-28(29)32)43-34(39)31(17-24-20-36-30-10-6-5-9-27(24)30)37-35(40)42-21-22-7-3-2-4-8-22/h2-16,18-20,31,36H,17,21H2,1H3,(H,37,40)