[3-(2-methylpropylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 4-(4-methoxyphenoxy)butanoate

Systemtic Name: [3-(2-methylpropylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 4-(4-methoxyphenoxy)butanoate Openeye Name: [3-(isobutylcarbamoyl)-2-oxo-chromen-7-yl] 4-(4-methoxyphenoxy)butanoate CAS Name: 4-(4-methoxyphenoxy)butanoic acid [3-[(2-methylpropylamino)-oxomethyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(2-methylpropylcarbamoyl)-2-oxochromen-7-yl] 4-(4-methoxyphenoxy)butanoate Traditional Name: 4-(4-methoxyphenoxy)butyric acid [3-(isobutylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C25H27NO7 MolecularWeight: 453.48438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CC2=C(C=C(C=C2)OC(=O)CCCOC3=CC=C(C=C3)OC)OC1=O

Isomeric SMILES

CC(C)CNC(=O)C1=CC2=C(C=C(C=C2)OC(=O)CCCOC3=CC=C(C=C3)OC)OC1=O

InChI

InChI=1S/C25H27NO7/c1-16(2)15-26-24(28)21-13-17-6-7-20(14-22(17)33-25(21)29)32-23(27)5-4-12-31-19-10-8-18(30-3)9-11-19/h6-11,13-14,16H,4-5,12,15H2,1-3H3,(H,26,28)