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

Systemtic Name: [3-(cyclohexylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 4-(3-methylphenoxy)butanoate Openeye Name: [3-(cyclohexylcarbamoyl)-2-oxo-chromen-7-yl] 4-(3-methylphenoxy)butanoate CAS Name: 4-(3-methylphenoxy)butanoic acid [3-[(cyclohexylamino)-oxomethyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(cyclohexylcarbamoyl)-2-oxochromen-7-yl] 4-(3-methylphenoxy)butanoate Traditional Name: 4-(3-methylphenoxy)butyric acid [3-(cyclohexylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C27H29NO6 MolecularWeight: 463.52226

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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)NC4CCCCC4

Isomeric SMILES

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

InChI

InChI=1S/C27H29NO6/c1-18-7-5-10-21(15-18)32-14-6-11-25(29)33-22-13-12-19-16-23(27(31)34-24(19)17-22)26(30)28-20-8-3-2-4-9-20/h5,7,10,12-13,15-17,20H,2-4,6,8-9,11,14H2,1H3,(H,28,30)