(E)-but-2-enedioic acid; N-[2-(phenylsulfonyl)ethyl]-2-piperidin-1-yl-ethanamine

Systemtic Name: (E)-but-2-enedioic acid; N-[2-(phenylsulfonyl)ethyl]-2-piperidin-1-yl-ethanamine Openeye Name: N-[2-(benzenesulfonyl)ethyl]-2-(1-piperidyl)ethanamine; fumaric acid CAS Name: N-[2-(benzenesulfonyl)ethyl]-2-(1-piperidinyl)ethanamine; (E)-2-butenedioic acid IUPAC Name: N-[2-(benzenesulfonyl)ethyl]-2-piperidin-1-ylethanamine; (E)-but-2-enedioic acid Traditional Name: 2-besylethyl(2-piperidinoethyl)amine; fumaric acid Formula: C19H28N2O6S MolecularWeight: 412.50042

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCNCCS(=O)(=O)C2=CC=CC=C2.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1CCN(CC1)CCNCCS(=O)(=O)C2=CC=CC=C2.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C15H24N2O2S.C4H4O4/c18-20(19,15-7-3-1-4-8-15)14-10-16-9-13-17-11-5-2-6-12-17;5-3(6)1-2-4(7)8/h1,3-4,7-8,16H,2,5-6,9-14H2;1-2H,(H,5,6)(H,7,8)/b;2-1+