(6-chloranyl-2-oxidanylidene-4-phenyl-chromen-7-yl) 3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: (6-chloranyl-2-oxidanylidene-4-phenyl-chromen-7-yl) 3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: (6-chloro-2-oxo-4-phenyl-chromen-7-yl) 2-(benzyloxycarbonylamino)-3-(1H-indol-3-yl)propanoate CAS Name: 3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoic acid (6-chloro-2-oxo-4-phenyl-1-benzopyran-7-yl) ester IUPAC Name: (6-chloro-2-oxo-4-phenylchromen-7-yl) 3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-(1H-indol-3-yl)propionic acid (6-chloro-2-keto-4-phenyl-chromen-7-yl) ester Formula: C34H25ClN2O6 MolecularWeight: 593.0251

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OC4=C(C=C5C(=CC(=O)OC5=C4)C6=CC=CC=C6)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OC4=C(C=C5C(=CC(=O)OC5=C4)C6=CC=CC=C6)Cl

InChI

InChI=1S/C34H25ClN2O6/c35-27-16-26-25(22-11-5-2-6-12-22)17-32(38)42-30(26)18-31(27)43-33(39)29(15-23-19-36-28-14-8-7-13-24(23)28)37-34(40)41-20-21-9-3-1-4-10-21/h1-14,16-19,29,36H,15,20H2,(H,37,40)