1-[(E)-2-(3,4-dichlorophenyl)ethenyl]sulfonylpiperidine-4-carboxylic acid

Systemtic Name: 1-[(E)-2-(3,4-dichlorophenyl)ethenyl]sulfonylpiperidine-4-carboxylic acid Openeye Name: 1-[(E)-2-(3,4-dichlorophenyl)vinyl]sulfonylpiperidine-4-carboxylic acid CAS Name: 1-[(E)-2-(3,4-dichlorophenyl)ethenyl]sulfonyl-4-piperidinecarboxylic acid IUPAC Name: 1-[(E)-2-(3,4-dichlorophenyl)ethenyl]sulfonylpiperidine-4-carboxylic acid Traditional Name: 1-[(E)-2-(3,4-dichlorophenyl)vinyl]sulfonylisonipecotic acid Formula: C14H15Cl2NO4S MolecularWeight: 364.2442

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)S(=O)(=O)C=CC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

C1CN(CCC1C(=O)O)S(=O)(=O)/C=C/C2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C14H15Cl2NO4S/c15-12-2-1-10(9-13(12)16)5-8-22(20,21)17-6-3-11(4-7-17)14(18)19/h1-2,5,8-9,11H,3-4,6-7H2,(H,18,19)/b8-5+