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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC(C)NC(=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/c1-6-18(2)29-26(31)23-16-19-9-12-22(17-24(19)35-27(23)32)34-25(30)8-7-15-33-21-13-10-20(11-14-21)28(3,4)5/h9-14,16-18H,6-8,15H2,1-5H3,(H,29,31)