(6-chloranyl-3,4-dimethyl-2-oxidanylidene-chromen-7-yl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: (6-chloranyl-3,4-dimethyl-2-oxidanylidene-chromen-7-yl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: (6-chloro-3,4-dimethyl-2-oxo-chromen-7-yl) 2-(benzyloxycarbonylamino)-3-phenyl-propanoate CAS Name: 3-phenyl-2-(phenylmethoxycarbonylamino)propanoic acid (6-chloro-3,4-dimethyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (6-chloro-3,4-dimethyl-2-oxochromen-7-yl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-phenyl-propionic acid (6-chloro-2-keto-3,4-dimethyl-chromen-7-yl) ester Formula: C28H24ClNO6 MolecularWeight: 505.94626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OC(=O)C(CC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OC(=O)C(CC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4)C

InChI

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