ethanedioic acid; N-[(2-nitrophenyl)methyl]cyclopentanamine

Systemtic Name: ethanedioic acid; N-[(2-nitrophenyl)methyl]cyclopentanamine Openeye Name: N-[(2-nitrophenyl)methyl]cyclopentanamine; oxalic acid CAS Name: N-[(2-nitrophenyl)methyl]cyclopentanamine; oxalic acid IUPAC Name: N-[(2-nitrophenyl)methyl]cyclopentanamine; oxalic acid Traditional Name: cyclopentyl-(2-nitrobenzyl)amine; oxalic acid Formula: C14H18N2O6 MolecularWeight: 310.30252

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NCC2=CC=CC=C2[N+](=O)[O-].C(=O)(C(=O)O)O

Isomeric SMILES

C1CCC(C1)NCC2=CC=CC=C2[N+](=O)[O-].C(=O)(C(=O)O)O

InChI

InChI=1S/C12H16N2O2.C2H2O4/c15-14(16)12-8-4-1-5-10(12)9-13-11-6-2-3-7-11;3-1(4)2(5)6/h1,4-5,8,11,13H,2-3,6-7,9H2;(H,3,4)(H,5,6)