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

Systemtic Name: [3-(2-methylpropylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 4-(3-methylphenoxy)butanoate Openeye Name: [3-(isobutylcarbamoyl)-2-oxo-chromen-7-yl] 4-(3-methylphenoxy)butanoate CAS Name: 4-(3-methylphenoxy)butanoic acid [3-[(2-methylpropylamino)-oxomethyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(2-methylpropylcarbamoyl)-2-oxochromen-7-yl] 4-(3-methylphenoxy)butanoate Traditional Name: 4-(3-methylphenoxy)butyric acid [3-(isobutylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C25H27NO6 MolecularWeight: 437.48498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCC(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NCC(C)C

Isomeric SMILES

CC1=CC(=CC=C1)OCCCC(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NCC(C)C

InChI

InChI=1S/C25H27NO6/c1-16(2)15-26-24(28)21-13-18-9-10-20(14-22(18)32-25(21)29)31-23(27)8-5-11-30-19-7-4-6-17(3)12-19/h4,6-7,9-10,12-14,16H,5,8,11,15H2,1-3H3,(H,26,28)