N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-1-(phenylmethyl)piperidin-4-amine; ethanedioic acid

Systemtic Name: N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-1-(phenylmethyl)piperidin-4-amine; ethanedioic acid Openeye Name: 1-benzyl-N-[(2-chloro-6-fluoro-phenyl)methyl]piperidin-4-amine; oxalic acid CAS Name: N-[(2-chloro-6-fluorophenyl)methyl]-1-(phenylmethyl)-4-piperidinamine; oxalic acid IUPAC Name: 1-benzyl-N-[(2-chloro-6-fluorophenyl)methyl]piperidin-4-amine; oxalic acid Traditional Name: (1-benzyl-4-piperidyl)-(2-chloro-6-fluoro-benzyl)amine; oxalic acid Formula: C21H24ClFN2O4 MolecularWeight: 422.877663

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NCC2=C(C=CC=C2Cl)F)CC3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCC1NCC2=C(C=CC=C2Cl)F)CC3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H22ClFN2.C2H2O4/c20-18-7-4-8-19(21)17(18)13-22-16-9-11-23(12-10-16)14-15-5-2-1-3-6-15;3-1(4)2(5)6/h1-8,16,22H,9-14H2;(H,3,4)(H,5,6)