ethanedioic acid; 3-methyl-1-[3-(4-nitrophenoxy)propyl]piperidine

Systemtic Name: ethanedioic acid; 3-methyl-1-[3-(4-nitrophenoxy)propyl]piperidine Openeye Name: 3-methyl-1-[3-(4-nitrophenoxy)propyl]piperidine; oxalic acid CAS Name: 3-methyl-1-[3-(4-nitrophenoxy)propyl]piperidine; oxalic acid IUPAC Name: 3-methyl-1-[3-(4-nitrophenoxy)propyl]piperidine; oxalic acid Traditional Name: 3-methyl-1-[3-(4-nitrophenoxy)propyl]piperidine; oxalic acid Formula: C17H24N2O7 MolecularWeight: 368.38166

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CCCOC2=CC=C(C=C2)[N+](=O)[O-].C(=O)(C(=O)O)O

Isomeric SMILES

CC1CCCN(C1)CCCOC2=CC=C(C=C2)[N+](=O)[O-].C(=O)(C(=O)O)O

InChI

InChI=1S/C15H22N2O3.C2H2O4/c1-13-4-2-9-16(12-13)10-3-11-20-15-7-5-14(6-8-15)17(18)19;3-1(4)2(5)6/h5-8,13H,2-4,9-12H2,1H3;(H,3,4)(H,5,6)