(4-butyl-6-chloranyl-2-oxidanylidene-chromen-7-yl) 2-(phenylmethoxycarbonylamino)ethanoate

Systemtic Name: (4-butyl-6-chloranyl-2-oxidanylidene-chromen-7-yl) 2-(phenylmethoxycarbonylamino)ethanoate Openeye Name: (4-butyl-6-chloro-2-oxo-chromen-7-yl) 2-(benzyloxycarbonylamino)acetate CAS Name: 2-(phenylmethoxycarbonylamino)acetic acid (4-butyl-6-chloro-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-butyl-6-chloro-2-oxochromen-7-yl) 2-(phenylmethoxycarbonylamino)acetate Traditional Name: 2-(benzyloxycarbonylamino)acetic acid (4-butyl-6-chloro-2-keto-chromen-7-yl) ester Formula: C23H22ClNO6 MolecularWeight: 443.87688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(=O)CNC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(=O)CNC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H22ClNO6/c1-2-3-9-16-10-21(26)30-19-12-20(18(24)11-17(16)19)31-22(27)13-25-23(28)29-14-15-7-5-4-6-8-15/h4-8,10-12H,2-3,9,13-14H2,1H3,(H,25,28)