(7-methyl-2-oxidanylidene-4-phenyl-chromen-5-yl) 4-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: (7-methyl-2-oxidanylidene-4-phenyl-chromen-5-yl) 4-(phenylmethoxycarbonylamino)butanoate Openeye Name: (7-methyl-2-oxo-4-phenyl-chromen-5-yl) 4-(benzyloxycarbonylamino)butanoate CAS Name: 4-(phenylmethoxycarbonylamino)butanoic acid (7-methyl-2-oxo-4-phenyl-1-benzopyran-5-yl) ester IUPAC Name: (7-methyl-2-oxo-4-phenylchromen-5-yl) 4-(phenylmethoxycarbonylamino)butanoate Traditional Name: 4-(benzyloxycarbonylamino)butyric acid (2-keto-7-methyl-4-phenyl-chromen-5-yl) ester Formula: C28H25NO6 MolecularWeight: 471.5012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=CC(=O)O2)C3=CC=CC=C3)C(=C1)OC(=O)CCCNC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C(=CC(=O)O2)C3=CC=CC=C3)C(=C1)OC(=O)CCCNC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H25NO6/c1-19-15-23(27-22(21-11-6-3-7-12-21)17-26(31)35-24(27)16-19)34-25(30)13-8-14-29-28(32)33-18-20-9-4-2-5-10-20/h2-7,9-12,15-17H,8,13-14,18H2,1H3,(H,29,32)