4-[4-[(4-chlorophenyl)sulfonyl-cyclopropyl-amino]piperidin-1-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[4-[(4-chlorophenyl)sulfonyl-cyclopropyl-amino]piperidin-1-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-[(4-chlorophenyl)sulfonyl-cyclopropyl-amino]-1-piperidyl]-4-oxo-butanoic acid CAS Name: 4-[4-[(4-chlorophenyl)sulfonyl-cyclopropylamino]-1-piperidinyl]-4-oxobutanoic acid IUPAC Name: 4-[4-[(4-chlorophenyl)sulfonyl-cyclopropylamino]piperidin-1-yl]-4-oxobutanoic acid Traditional Name: 4-[4-[(4-chlorophenyl)sulfonyl-cyclopropyl-amino]piperidino]-4-keto-butyric acid Formula: C18H23ClN2O5S MolecularWeight: 414.90362

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(C2CCN(CC2)C(=O)CCC(=O)O)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CC1N(C2CCN(CC2)C(=O)CCC(=O)O)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H23ClN2O5S/c19-13-1-5-16(6-2-13)27(25,26)21(14-3-4-14)15-9-11-20(12-10-15)17(22)7-8-18(23)24/h1-2,5-6,14-15H,3-4,7-12H2,(H,23,24)