1-[(4-bromophenyl)methyl]-3-[(1R)-1-chloranylethyl]piperidine; ethanedioic acid

Systemtic Name: 1-[(4-bromophenyl)methyl]-3-[(1R)-1-chloranylethyl]piperidine; ethanedioic acid Openeye Name: 1-[(4-bromophenyl)methyl]-3-[(1R)-1-chloroethyl]piperidine; oxalic acid CAS Name: 1-[(4-bromophenyl)methyl]-3-[(1R)-1-chloroethyl]piperidine; oxalic acid IUPAC Name: 1-[(4-bromophenyl)methyl]-3-[(1R)-1-chloroethyl]piperidine; oxalic acid Traditional Name: 1-(4-bromobenzyl)-3-[(1R)-1-chloroethyl]piperidine; oxalic acid Formula: C16H21BrClNO4 MolecularWeight: 406.69924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCN(C1)CC2=CC=C(C=C2)Br)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

C[C@H](C1CCCN(C1)CC2=CC=C(C=C2)Br)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H19BrClN.C2H2O4/c1-11(16)13-3-2-8-17(10-13)9-12-4-6-14(15)7-5-12;3-1(4)2(5)6/h4-7,11,13H,2-3,8-10H2,1H3;(H,3,4)(H,5,6)/t11-,13?;/m1./s1