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

Systemtic Name: (4-methyl-2-oxidanylidene-chromen-7-yl) 2-(phenylmethoxycarbonylamino)butanoate Openeye Name: (4-methyl-2-oxo-chromen-7-yl) 2-(benzyloxycarbonylamino)butanoate CAS Name: 2-(phenylmethoxycarbonylamino)butanoic acid (4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-methyl-2-oxochromen-7-yl) 2-(phenylmethoxycarbonylamino)butanoate Traditional Name: 2-(benzyloxycarbonylamino)butyric acid (2-keto-4-methyl-chromen-7-yl) ester Formula: C22H21NO6 MolecularWeight: 395.40524

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC1=CC2=C(C=C1)C(=CC(=O)O2)C)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)OC1=CC2=C(C=C1)C(=CC(=O)O2)C)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H21NO6/c1-3-18(23-22(26)27-13-15-7-5-4-6-8-15)21(25)28-16-9-10-17-14(2)11-20(24)29-19(17)12-16/h4-12,18H,3,13H2,1-2H3,(H,23,26)