(6-chloranyl-2-oxidanylidene-4-phenyl-chromen-7-yl) 3-methyl-2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: (6-chloranyl-2-oxidanylidene-4-phenyl-chromen-7-yl) 3-methyl-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: (6-chloro-2-oxo-4-phenyl-chromen-7-yl) 2-(benzyloxycarbonylamino)-3-methyl-butanoate CAS Name: 3-methyl-2-(phenylmethoxycarbonylamino)butanoic acid (6-chloro-2-oxo-4-phenyl-1-benzopyran-7-yl) ester IUPAC Name: (6-chloro-2-oxo-4-phenylchromen-7-yl) 3-methyl-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-methyl-butyric acid (6-chloro-2-keto-4-phenyl-chromen-7-yl) ester Formula: C28H24ClNO6 MolecularWeight: 505.94626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC1=C(C=C2C(=CC(=O)OC2=C1)C3=CC=CC=C3)Cl)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)C(C(=O)OC1=C(C=C2C(=CC(=O)OC2=C1)C3=CC=CC=C3)Cl)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H24ClNO6/c1-17(2)26(30-28(33)34-16-18-9-5-3-6-10-18)27(32)36-24-15-23-21(13-22(24)29)20(14-25(31)35-23)19-11-7-4-8-12-19/h3-15,17,26H,16H2,1-2H3,(H,30,33)