1-[(4-bromanylthiophen-2-yl)methyl]-4-(phenylmethyl)piperidine; ethanedioic acid

Systemtic Name: 1-[(4-bromanylthiophen-2-yl)methyl]-4-(phenylmethyl)piperidine; ethanedioic acid Openeye Name: 4-benzyl-1-[(4-bromo-2-thienyl)methyl]piperidine; oxalic acid CAS Name: 1-[(4-bromo-2-thiophenyl)methyl]-4-(phenylmethyl)piperidine; oxalic acid IUPAC Name: 4-benzyl-1-[(4-bromothiophen-2-yl)methyl]piperidine; oxalic acid Traditional Name: 4-benzyl-1-[(4-bromo-2-thienyl)methyl]piperidine; oxalic acid Formula: C19H22BrNO4S MolecularWeight: 440.35128

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CC3=CC(=CS3)Br.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CC3=CC(=CS3)Br.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H20BrNS.C2H2O4/c18-16-11-17(20-13-16)12-19-8-6-15(7-9-19)10-14-4-2-1-3-5-14;3-1(4)2(5)6/h1-5,11,13,15H,6-10,12H2;(H,3,4)(H,5,6)