3,5-dimethyl-1-[4-(2-nitrophenoxy)butyl]piperidine; ethanedioic acid

Systemtic Name: 3,5-dimethyl-1-[4-(2-nitrophenoxy)butyl]piperidine; ethanedioic acid Openeye Name: 3,5-dimethyl-1-[4-(2-nitrophenoxy)butyl]piperidine; oxalic acid CAS Name: 3,5-dimethyl-1-[4-(2-nitrophenoxy)butyl]piperidine; oxalic acid IUPAC Name: 3,5-dimethyl-1-[4-(2-nitrophenoxy)butyl]piperidine; oxalic acid Traditional Name: 3,5-dimethyl-1-[4-(2-nitrophenoxy)butyl]piperidine; oxalic acid Formula: C19H28N2O7 MolecularWeight: 396.43482

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)CCCCOC2=CC=CC=C2[N+](=O)[O-])C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1CC(CN(C1)CCCCOC2=CC=CC=C2[N+](=O)[O-])C.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H26N2O3.C2H2O4/c1-14-11-15(2)13-18(12-14)9-5-6-10-22-17-8-4-3-7-16(17)19(20)21;3-1(4)2(5)6/h3-4,7-8,14-15H,5-6,9-13H2,1-2H3;(H,3,4)(H,5,6)