1-[(2-chlorophenyl)methyl]-4-cycloheptyl-piperazine; ethanedioic acid

Systemtic Name: 1-[(2-chlorophenyl)methyl]-4-cycloheptyl-piperazine; ethanedioic acid Openeye Name: 1-[(2-chlorophenyl)methyl]-4-cycloheptyl-piperazine; oxalic acid CAS Name: 1-[(2-chlorophenyl)methyl]-4-cycloheptylpiperazine; oxalic acid IUPAC Name: 1-[(2-chlorophenyl)methyl]-4-cycloheptylpiperazine; oxalic acid Traditional Name: 1-(2-chlorobenzyl)-4-cycloheptyl-piperazine; oxalic acid Formula: C20H29ClN2O4 MolecularWeight: 396.90826

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)N2CCN(CC2)CC3=CC=CC=C3Cl.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCCC(CC1)N2CCN(CC2)CC3=CC=CC=C3Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H27ClN2.C2H2O4/c19-18-10-6-5-7-16(18)15-20-11-13-21(14-12-20)17-8-3-1-2-4-9-17;3-1(4)2(5)6/h5-7,10,17H,1-4,8-9,11-15H2;(H,3,4)(H,5,6)