[4-(4-methoxyphenyl)-8-methyl-2-oxidanylidene-chromen-7-yl] 3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: [4-(4-methoxyphenyl)-8-methyl-2-oxidanylidene-chromen-7-yl] 3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: [4-(4-methoxyphenyl)-8-methyl-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)-8-methyl-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [4-(4-methoxyphenyl)-8-methyl-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)-8-methyl-chromen-7-yl] ester Formula: C36H30N2O7 MolecularWeight: 602.6326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2C3=CC=C(C=C3)OC)OC(=O)C(CC4=CNC5=CC=CC=C54)NC(=O)OCC6=CC=CC=C6

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2C3=CC=C(C=C3)OC)OC(=O)C(CC4=CNC5=CC=CC=C54)NC(=O)OCC6=CC=CC=C6

InChI

InChI=1S/C36H30N2O7/c1-22-32(17-16-28-29(19-33(39)45-34(22)28)24-12-14-26(42-2)15-13-24)44-35(40)31(18-25-20-37-30-11-7-6-10-27(25)30)38-36(41)43-21-23-8-4-3-5-9-23/h3-17,19-20,31,37H,18,21H2,1-2H3,(H,38,41)