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

Systemtic Name: [3-(2-methylpropylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 4-(4-tert-butylphenoxy)butanoate Openeye Name: [3-(isobutylcarbamoyl)-2-oxo-chromen-7-yl] 4-(4-tert-butylphenoxy)butanoate CAS Name: 4-(4-tert-butylphenoxy)butanoic acid [3-[(2-methylpropylamino)-oxomethyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(2-methylpropylcarbamoyl)-2-oxochromen-7-yl] 4-(4-tert-butylphenoxy)butanoate Traditional Name: 4-(4-tert-butylphenoxy)butyric acid [3-(isobutylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C28H33NO6 MolecularWeight: 479.56472

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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)C(C)(C)C)OC1=O

Isomeric SMILES

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

InChI

InChI=1S/C28H33NO6/c1-18(2)17-29-26(31)23-15-19-8-11-22(16-24(19)35-27(23)32)34-25(30)7-6-14-33-21-12-9-20(10-13-21)28(3,4)5/h8-13,15-16,18H,6-7,14,17H2,1-5H3,(H,29,31)