(4-ethyl-8-methyl-2-oxidanylidene-chromen-7-yl) 6-(phenylmethoxycarbonylamino)hexanoate

Systemtic Name: (4-ethyl-8-methyl-2-oxidanylidene-chromen-7-yl) 6-(phenylmethoxycarbonylamino)hexanoate Openeye Name: (4-ethyl-8-methyl-2-oxo-chromen-7-yl) 6-(benzyloxycarbonylamino)hexanoate CAS Name: 6-(phenylmethoxycarbonylamino)hexanoic acid (4-ethyl-8-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-ethyl-8-methyl-2-oxochromen-7-yl) 6-(phenylmethoxycarbonylamino)hexanoate Traditional Name: 6-(benzyloxycarbonylamino)hexanoic acid (4-ethyl-2-keto-8-methyl-chromen-7-yl) ester Formula: C26H29NO6 MolecularWeight: 451.51156

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C1C=CC(=C2C)OC(=O)CCCCCNC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCC1=CC(=O)OC2=C1C=CC(=C2C)OC(=O)CCCCCNC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C26H29NO6/c1-3-20-16-24(29)33-25-18(2)22(14-13-21(20)25)32-23(28)12-8-5-9-15-27-26(30)31-17-19-10-6-4-7-11-19/h4,6-7,10-11,13-14,16H,3,5,8-9,12,15,17H2,1-2H3,(H,27,30)