(6-chloranyl-3,4-dimethyl-2-oxidanylidene-chromen-7-yl) 2-(phenylmethoxycarbonylamino)ethanoate

Systemtic Name: (6-chloranyl-3,4-dimethyl-2-oxidanylidene-chromen-7-yl) 2-(phenylmethoxycarbonylamino)ethanoate Openeye Name: (6-chloro-3,4-dimethyl-2-oxo-chromen-7-yl) 2-(benzyloxycarbonylamino)acetate CAS Name: 2-(phenylmethoxycarbonylamino)acetic acid (6-chloro-3,4-dimethyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (6-chloro-3,4-dimethyl-2-oxochromen-7-yl) 2-(phenylmethoxycarbonylamino)acetate Traditional Name: 2-(benzyloxycarbonylamino)acetic acid (6-chloro-2-keto-3,4-dimethyl-chromen-7-yl) ester Formula: C21H18ClNO6 MolecularWeight: 415.82372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OC(=O)CNC(=O)OCC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OC(=O)CNC(=O)OCC3=CC=CC=C3)C

InChI

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