(4-butyl-7-methyl-2-oxidanylidene-chromen-5-yl) 3-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: (4-butyl-7-methyl-2-oxidanylidene-chromen-5-yl) 3-(phenylmethoxycarbonylamino)propanoate Openeye Name: (4-butyl-7-methyl-2-oxo-chromen-5-yl) 3-(benzyloxycarbonylamino)propanoate CAS Name: 3-(phenylmethoxycarbonylamino)propanoic acid (4-butyl-7-methyl-2-oxo-1-benzopyran-5-yl) ester IUPAC Name: (4-butyl-7-methyl-2-oxochromen-5-yl) 3-(phenylmethoxycarbonylamino)propanoate Traditional Name: 3-(benzyloxycarbonylamino)propionic acid (4-butyl-2-keto-7-methyl-chromen-5-yl) ester Formula: C25H27NO6 MolecularWeight: 437.48498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(=O)CCNC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(=O)CCNC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C25H27NO6/c1-3-4-10-19-15-23(28)32-21-14-17(2)13-20(24(19)21)31-22(27)11-12-26-25(29)30-16-18-8-6-5-7-9-18/h5-9,13-15H,3-4,10-12,16H2,1-2H3,(H,26,29)