(4-butyl-8-methyl-2-oxidanylidene-chromen-7-yl) 2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: (4-butyl-8-methyl-2-oxidanylidene-chromen-7-yl) 2-(phenylmethoxycarbonylamino)butanoate Openeye Name: (4-butyl-8-methyl-2-oxo-chromen-7-yl) 2-(benzyloxycarbonylamino)butanoate CAS Name: 2-(phenylmethoxycarbonylamino)butanoic acid (4-butyl-8-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-butyl-8-methyl-2-oxochromen-7-yl) 2-(phenylmethoxycarbonylamino)butanoate Traditional Name: 2-(benzyloxycarbonylamino)butyric acid (4-butyl-2-keto-8-methyl-chromen-7-yl) ester Formula: C26H29NO6 MolecularWeight: 451.51156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C=CC(=C2C)OC(=O)C(CC)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C=CC(=C2C)OC(=O)C(CC)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C26H29NO6/c1-4-6-12-19-15-23(28)33-24-17(3)22(14-13-20(19)24)32-25(29)21(5-2)27-26(30)31-16-18-10-8-7-9-11-18/h7-11,13-15,21H,4-6,12,16H2,1-3H3,(H,27,30)