5-oxidanylidene-5-[4-(phenylsulfonyl)piperazin-1-yl]pentanoic acid

Systemtic Name: 5-oxidanylidene-5-[4-(phenylsulfonyl)piperazin-1-yl]pentanoic acid Openeye Name: 5-[4-(benzenesulfonyl)piperazin-1-yl]-5-oxo-pentanoic acid CAS Name: 5-[4-(benzenesulfonyl)-1-piperazinyl]-5-oxopentanoic acid IUPAC Name: 5-[4-(benzenesulfonyl)piperazin-1-yl]-5-oxopentanoic acid Traditional Name: 5-(4-besylpiperazino)-5-keto-valeric acid Formula: C15H20N2O5S MolecularWeight: 340.3947

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCCC(=O)O)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C1CN(CCN1C(=O)CCCC(=O)O)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H20N2O5S/c18-14(7-4-8-15(19)20)16-9-11-17(12-10-16)23(21,22)13-5-2-1-3-6-13/h1-3,5-6H,4,7-12H2,(H,19,20)