1-cyclopentyl-4-[(3-nitrophenyl)methyl]piperazine; ethanedioic acid

Systemtic Name: 1-cyclopentyl-4-[(3-nitrophenyl)methyl]piperazine; ethanedioic acid Openeye Name: 1-cyclopentyl-4-[(3-nitrophenyl)methyl]piperazine; oxalic acid CAS Name: 1-cyclopentyl-4-[(3-nitrophenyl)methyl]piperazine; oxalic acid IUPAC Name: 1-cyclopentyl-4-[(3-nitrophenyl)methyl]piperazine; oxalic acid Traditional Name: 1-cyclopentyl-4-(3-nitrobenzyl)piperazine; oxalic acid Formula: C18H25N3O6 MolecularWeight: 379.4076

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2CCN(CC2)CC3=CC(=CC=C3)[N+](=O)[O-].C(=O)(C(=O)O)O

Isomeric SMILES

C1CCC(C1)N2CCN(CC2)CC3=CC(=CC=C3)[N+](=O)[O-].C(=O)(C(=O)O)O

InChI

InChI=1S/C16H23N3O2.C2H2O4/c20-19(21)16-7-3-4-14(12-16)13-17-8-10-18(11-9-17)15-5-1-2-6-15;3-1(4)2(5)6/h3-4,7,12,15H,1-2,5-6,8-11,13H2;(H,3,4)(H,5,6)