5-(4-chlorophenyl)-3-(3,3-dimethyl-2-oxidanylidene-azetidin-1-yl)thiophene-2-carboxylic acid

Systemtic Name: 5-(4-chlorophenyl)-3-(3,3-dimethyl-2-oxidanylidene-azetidin-1-yl)thiophene-2-carboxylic acid Openeye Name: 5-(4-chlorophenyl)-3-(3,3-dimethyl-2-oxo-azetidin-1-yl)thiophene-2-carboxylic acid CAS Name: 5-(4-chlorophenyl)-3-(3,3-dimethyl-2-oxo-1-azetidinyl)-2-thiophenecarboxylic acid IUPAC Name: 5-(4-chlorophenyl)-3-(3,3-dimethyl-2-oxoazetidin-1-yl)thiophene-2-carboxylic acid Traditional Name: 5-(4-chlorophenyl)-3-(2-keto-3,3-dimethyl-azetidin-1-yl)-2-thenoic acid Formula: C16H14ClNO3S MolecularWeight: 335.80526

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C1=O)C2=C(SC(=C2)C3=CC=C(C=C3)Cl)C(=O)O)C

Isomeric SMILES

CC1(CN(C1=O)C2=C(SC(=C2)C3=CC=C(C=C3)Cl)C(=O)O)C

InChI

InChI=1S/C16H14ClNO3S/c1-16(2)8-18(15(16)21)11-7-12(22-13(11)14(19)20)9-3-5-10(17)6-4-9/h3-7H,8H2,1-2H3,(H,19,20)