[3-(cyclohexylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 4-(4-ethylphenoxy)butanoate

Systemtic Name: [3-(cyclohexylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 4-(4-ethylphenoxy)butanoate Openeye Name: [3-(cyclohexylcarbamoyl)-2-oxo-chromen-7-yl] 4-(4-ethylphenoxy)butanoate CAS Name: 4-(4-ethylphenoxy)butanoic acid [3-[(cyclohexylamino)-oxomethyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(cyclohexylcarbamoyl)-2-oxochromen-7-yl] 4-(4-ethylphenoxy)butanoate Traditional Name: 4-(4-ethylphenoxy)butyric acid [3-(cyclohexylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C28H31NO6 MolecularWeight: 477.54884

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCCCC(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NC4CCCCC4

Isomeric SMILES

CCC1=CC=C(C=C1)OCCCC(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NC4CCCCC4

InChI

InChI=1S/C28H31NO6/c1-2-19-10-13-22(14-11-19)33-16-6-9-26(30)34-23-15-12-20-17-24(28(32)35-25(20)18-23)27(31)29-21-7-4-3-5-8-21/h10-15,17-18,21H,2-9,16H2,1H3,(H,29,31)