[3-(cyclohexylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 4-(2,5-dimethylphenoxy)butanoate

Systemtic Name: [3-(cyclohexylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 4-(2,5-dimethylphenoxy)butanoate Openeye Name: [3-(cyclohexylcarbamoyl)-2-oxo-chromen-7-yl] 4-(2,5-dimethylphenoxy)butanoate CAS Name: 4-(2,5-dimethylphenoxy)butanoic acid [3-[(cyclohexylamino)-oxomethyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(cyclohexylcarbamoyl)-2-oxochromen-7-yl] 4-(2,5-dimethylphenoxy)butanoate Traditional Name: 4-(2,5-dimethylphenoxy)butyric acid [3-(cyclohexylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C28H31NO6 MolecularWeight: 477.54884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCCCC(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NC4CCCCC4

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCCCC(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NC4CCCCC4

InChI

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