(8-methyl-2-oxidanylidene-4-phenyl-chromen-7-yl) 2-(phenylmethoxycarbonylamino)pentanoate

Systemtic Name: (8-methyl-2-oxidanylidene-4-phenyl-chromen-7-yl) 2-(phenylmethoxycarbonylamino)pentanoate Openeye Name: (8-methyl-2-oxo-4-phenyl-chromen-7-yl) 2-(benzyloxycarbonylamino)pentanoate CAS Name: 2-(phenylmethoxycarbonylamino)pentanoic acid (8-methyl-2-oxo-4-phenyl-1-benzopyran-7-yl) ester IUPAC Name: (8-methyl-2-oxo-4-phenylchromen-7-yl) 2-(phenylmethoxycarbonylamino)pentanoate Traditional Name: 2-(benzyloxycarbonylamino)valeric acid (2-keto-8-methyl-4-phenyl-chromen-7-yl) ester Formula: C29H27NO6 MolecularWeight: 485.52778

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)OC1=C(C2=C(C=C1)C(=CC(=O)O2)C3=CC=CC=C3)C)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CCCC(C(=O)OC1=C(C2=C(C=C1)C(=CC(=O)O2)C3=CC=CC=C3)C)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C29H27NO6/c1-3-10-24(30-29(33)34-18-20-11-6-4-7-12-20)28(32)35-25-16-15-22-23(21-13-8-5-9-14-21)17-26(31)36-27(22)19(25)2/h4-9,11-17,24H,3,10,18H2,1-2H3,(H,30,33)