(7-methyl-2-oxidanylidene-4-propyl-chromen-5-yl) 2-(phenylmethoxycarbonylamino)pentanoate

Systemtic Name: (7-methyl-2-oxidanylidene-4-propyl-chromen-5-yl) 2-(phenylmethoxycarbonylamino)pentanoate Openeye Name: (7-methyl-2-oxo-4-propyl-chromen-5-yl) 2-(benzyloxycarbonylamino)pentanoate CAS Name: 2-(phenylmethoxycarbonylamino)pentanoic acid (7-methyl-2-oxo-4-propyl-1-benzopyran-5-yl) ester IUPAC Name: (7-methyl-2-oxo-4-propylchromen-5-yl) 2-(phenylmethoxycarbonylamino)pentanoate Traditional Name: 2-(benzyloxycarbonylamino)valeric acid (2-keto-7-methyl-4-propyl-chromen-5-yl) ester Formula: C26H29NO6 MolecularWeight: 451.51156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(=O)C(CCC)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(=O)C(CCC)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C26H29NO6/c1-4-9-19-15-23(28)32-21-13-17(3)14-22(24(19)21)33-25(29)20(10-5-2)27-26(30)31-16-18-11-7-6-8-12-18/h6-8,11-15,20H,4-5,9-10,16H2,1-3H3,(H,27,30)