(3,4,8-trimethyl-2-oxidanylidene-chromen-7-yl) 3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: (3,4,8-trimethyl-2-oxidanylidene-chromen-7-yl) 3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: (3,4,8-trimethyl-2-oxo-chromen-7-yl) 2-(benzyloxycarbonylamino)-3-(1H-indol-3-yl)propanoate CAS Name: 3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoic acid (3,4,8-trimethyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (3,4,8-trimethyl-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-3,4,8-trimethyl-chromen-7-yl) ester Formula: C31H28N2O6 MolecularWeight: 524.56382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)OC(=O)C(CC3=CNC4=CC=CC=C43)NC(=O)OCC5=CC=CC=C5)C

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)OC(=O)C(CC3=CNC4=CC=CC=C43)NC(=O)OCC5=CC=CC=C5)C

InChI

InChI=1S/C31H28N2O6/c1-18-19(2)29(34)39-28-20(3)27(14-13-23(18)28)38-30(35)26(15-22-16-32-25-12-8-7-11-24(22)25)33-31(36)37-17-21-9-5-4-6-10-21/h4-14,16,26,32H,15,17H2,1-3H3,(H,33,36)