(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: (7-methoxy-2-oxo-chromen-4-yl)methyl 2-(benzyloxycarbonylamino)-3-phenyl-propanoate CAS Name: 3-phenyl-2-(phenylmethoxycarbonylamino)propanoic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-phenyl-propionic acid (2-keto-7-methoxy-chromen-4-yl)methyl ester Formula: C28H25NO7 MolecularWeight: 487.5006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C(CC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C(CC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H25NO7/c1-33-22-12-13-23-21(15-26(30)36-25(23)16-22)18-34-27(31)24(14-19-8-4-2-5-9-19)29-28(32)35-17-20-10-6-3-7-11-20/h2-13,15-16,24H,14,17-18H2,1H3,(H,29,32)