1-(1,3-benzothiazol-2-yl)ethyl 4-(4-chlorophenyl)-4-oxidanylidene-butanoate

Systemtic Name: 1-(1,3-benzothiazol-2-yl)ethyl 4-(4-chlorophenyl)-4-oxidanylidene-butanoate Openeye Name: 1-(1,3-benzothiazol-2-yl)ethyl 4-(4-chlorophenyl)-4-oxo-butanoate CAS Name: 4-(4-chlorophenyl)-4-oxobutanoic acid 1-(1,3-benzothiazol-2-yl)ethyl ester IUPAC Name: 1-(1,3-benzothiazol-2-yl)ethyl 4-(4-chlorophenyl)-4-oxobutanoate Traditional Name: 4-(4-chlorophenyl)-4-keto-butyric acid 1-(1,3-benzothiazol-2-yl)ethyl ester Formula: C19H16ClNO3S MolecularWeight: 373.85324

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)OC(=O)CCC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C1=NC2=CC=CC=C2S1)OC(=O)CCC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H16ClNO3S/c1-12(19-21-15-4-2-3-5-17(15)25-19)24-18(23)11-10-16(22)13-6-8-14(20)9-7-13/h2-9,12H,10-11H2,1H3