ethanedioic acid; 4-methyl-1-[4-(2-nitrophenoxy)butyl]piperidine

Systemtic Name: ethanedioic acid; 4-methyl-1-[4-(2-nitrophenoxy)butyl]piperidine Openeye Name: 4-methyl-1-[4-(2-nitrophenoxy)butyl]piperidine; oxalic acid CAS Name: 4-methyl-1-[4-(2-nitrophenoxy)butyl]piperidine; oxalic acid IUPAC Name: 4-methyl-1-[4-(2-nitrophenoxy)butyl]piperidine; oxalic acid Traditional Name: 4-methyl-1-[4-(2-nitrophenoxy)butyl]piperidine; oxalic acid Formula: C18H26N2O7 MolecularWeight: 382.40824

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CCCCOC2=CC=CC=C2[N+](=O)[O-].C(=O)(C(=O)O)O

Isomeric SMILES

CC1CCN(CC1)CCCCOC2=CC=CC=C2[N+](=O)[O-].C(=O)(C(=O)O)O

InChI

InChI=1S/C16H24N2O3.C2H2O4/c1-14-8-11-17(12-9-14)10-4-5-13-21-16-7-3-2-6-15(16)18(19)20;3-1(4)2(5)6/h2-3,6-7,14H,4-5,8-13H2,1H3;(H,3,4)(H,5,6)