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

Systemtic Name: (4-butyl-6-chloranyl-2-oxidanylidene-chromen-7-yl) 2-(phenylmethoxycarbonylamino)propanoate Openeye Name: (4-butyl-6-chloro-2-oxo-chromen-7-yl) 2-(benzyloxycarbonylamino)propanoate CAS Name: 2-(phenylmethoxycarbonylamino)propanoic acid (4-butyl-6-chloro-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-butyl-6-chloro-2-oxochromen-7-yl) 2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)propionic acid (4-butyl-6-chloro-2-keto-chromen-7-yl) ester Formula: C24H24ClNO6 MolecularWeight: 457.90346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H24ClNO6/c1-3-4-10-17-11-22(27)31-20-13-21(19(25)12-18(17)20)32-23(28)15(2)26-24(29)30-14-16-8-6-5-7-9-16/h5-9,11-13,15H,3-4,10,14H2,1-2H3,(H,26,29)