[4-(4-methoxyphenyl)-8-methyl-2-oxidanylidene-chromen-7-yl] 6-(phenylmethoxycarbonylamino)hexanoate

Systemtic Name: [4-(4-methoxyphenyl)-8-methyl-2-oxidanylidene-chromen-7-yl] 6-(phenylmethoxycarbonylamino)hexanoate Openeye Name: [4-(4-methoxyphenyl)-8-methyl-2-oxo-chromen-7-yl] 6-(benzyloxycarbonylamino)hexanoate CAS Name: 6-(phenylmethoxycarbonylamino)hexanoic acid [4-(4-methoxyphenyl)-8-methyl-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [4-(4-methoxyphenyl)-8-methyl-2-oxochromen-7-yl] 6-(phenylmethoxycarbonylamino)hexanoate Traditional Name: 6-(benzyloxycarbonylamino)hexanoic acid [2-keto-4-(4-methoxyphenyl)-8-methyl-chromen-7-yl] ester Formula: C31H31NO7 MolecularWeight: 529.58034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2C3=CC=C(C=C3)OC)OC(=O)CCCCCNC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2C3=CC=C(C=C3)OC)OC(=O)CCCCCNC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C31H31NO7/c1-21-27(17-16-25-26(19-29(34)39-30(21)25)23-12-14-24(36-2)15-13-23)38-28(33)11-7-4-8-18-32-31(35)37-20-22-9-5-3-6-10-22/h3,5-6,9-10,12-17,19H,4,7-8,11,18,20H2,1-2H3,(H,32,35)