ethanedioic acid; 1-[2-(4-methyl-2-nitro-phenoxy)ethyl]piperidine

Systemtic Name: ethanedioic acid; 1-[2-(4-methyl-2-nitro-phenoxy)ethyl]piperidine Openeye Name: 1-[2-(4-methyl-2-nitro-phenoxy)ethyl]piperidine; oxalic acid CAS Name: 1-[2-(4-methyl-2-nitrophenoxy)ethyl]piperidine; oxalic acid IUPAC Name: 1-[2-(4-methyl-2-nitrophenoxy)ethyl]piperidine; oxalic acid Traditional Name: 1-[2-(4-methyl-2-nitro-phenoxy)ethyl]piperidine; oxalic acid Formula: C16H22N2O7 MolecularWeight: 354.35508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCN2CCCCC2)[N+](=O)[O-].C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C=C1)OCCN2CCCCC2)[N+](=O)[O-].C(=O)(C(=O)O)O

InChI

InChI=1S/C14H20N2O3.C2H2O4/c1-12-5-6-14(13(11-12)16(17)18)19-10-9-15-7-3-2-4-8-15;3-1(4)2(5)6/h5-6,11H,2-4,7-10H2,1H3;(H,3,4)(H,5,6)