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

Systemtic Name: (3-chloranyl-4-methyl-2-oxidanylidene-chromen-7-yl) 2-(phenylmethoxycarbonylamino)propanoate Openeye Name: (3-chloro-4-methyl-2-oxo-chromen-7-yl) 2-(benzyloxycarbonylamino)propanoate CAS Name: 2-(phenylmethoxycarbonylamino)propanoic acid (3-chloro-4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (3-chloro-4-methyl-2-oxochromen-7-yl) 2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)propionic acid (3-chloro-2-keto-4-methyl-chromen-7-yl) ester Formula: C21H18ClNO6 MolecularWeight: 415.82372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OC(=O)C(C)NC(=O)OCC3=CC=CC=C3)Cl

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OC(=O)C(C)NC(=O)OCC3=CC=CC=C3)Cl

InChI

InChI=1S/C21H18ClNO6/c1-12-16-9-8-15(10-17(16)29-20(25)18(12)22)28-19(24)13(2)23-21(26)27-11-14-6-4-3-5-7-14/h3-10,13H,11H2,1-2H3,(H,23,26)