(2-oxidanylidenechromen-7-yl) 4-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: (2-oxidanylidenechromen-7-yl) 4-(phenylmethoxycarbonylamino)butanoate Openeye Name: (2-oxochromen-7-yl) 4-(benzyloxycarbonylamino)butanoate CAS Name: 4-(phenylmethoxycarbonylamino)butanoic acid (2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (2-oxochromen-7-yl) 4-(phenylmethoxycarbonylamino)butanoate Traditional Name: 4-(benzyloxycarbonylamino)butyric acid (2-ketochromen-7-yl) ester Formula: C21H19NO6 MolecularWeight: 381.37866

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCCCC(=O)OC2=CC3=C(C=C2)C=CC(=O)O3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCCCC(=O)OC2=CC3=C(C=C2)C=CC(=O)O3

InChI

InChI=1S/C21H19NO6/c23-19(27-17-10-8-16-9-11-20(24)28-18(16)13-17)7-4-12-22-21(25)26-14-15-5-2-1-3-6-15/h1-3,5-6,8-11,13H,4,7,12,14H2,(H,22,25)