3-(7-methoxy-2-oxidanylidene-chromen-4-yl)-2-(phenylmethoxycarbonylamino)propanoic acid

Systemtic Name: 3-(7-methoxy-2-oxidanylidene-chromen-4-yl)-2-(phenylmethoxycarbonylamino)propanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-3-(7-methoxy-2-oxo-chromen-4-yl)propanoic acid CAS Name: 3-(7-methoxy-2-oxo-1-benzopyran-4-yl)-2-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: 3-(7-methoxy-2-oxochromen-4-yl)-2-(phenylmethoxycarbonylamino)propanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-3-(2-keto-7-methoxy-chromen-4-yl)propionic acid Formula: C21H19NO7 MolecularWeight: 397.37806

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CC(C(=O)O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CC(C(=O)O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H19NO7/c1-27-15-7-8-16-14(10-19(23)29-18(16)11-15)9-17(20(24)25)22-21(26)28-12-13-5-3-2-4-6-13/h2-8,10-11,17H,9,12H2,1H3,(H,22,26)(H,24,25)