[1-(4-chlorophenyl)-1-oxidanylidene-propan-2-yl] 4-(thiophen-3-ylcarbonylamino)butanoate

Systemtic Name: [1-(4-chlorophenyl)-1-oxidanylidene-propan-2-yl] 4-(thiophen-3-ylcarbonylamino)butanoate Openeye Name: [2-(4-chlorophenyl)-1-methyl-2-oxo-ethyl] 4-(thiophene-3-carbonylamino)butanoate CAS Name: 4-[[oxo(3-thiophenyl)methyl]amino]butanoic acid [1-(4-chlorophenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-chlorophenyl)-1-oxopropan-2-yl] 4-(thiophene-3-carbonylamino)butanoate Traditional Name: 4-(3-thenoylamino)butyric acid [2-(4-chlorophenyl)-2-keto-1-methyl-ethyl] ester Formula: C18H18ClNO4S MolecularWeight: 379.85782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)Cl)OC(=O)CCCNC(=O)C2=CSC=C2

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)Cl)OC(=O)CCCNC(=O)C2=CSC=C2

InChI

InChI=1S/C18H18ClNO4S/c1-12(17(22)13-4-6-15(19)7-5-13)24-16(21)3-2-9-20-18(23)14-8-10-25-11-14/h4-8,10-12H,2-3,9H2,1H3,(H,20,23)