ethanedioic acid; N-[3-(4-nitrophenoxy)propyl]cyclopentanamine

Systemtic Name: ethanedioic acid; N-[3-(4-nitrophenoxy)propyl]cyclopentanamine Openeye Name: N-[3-(4-nitrophenoxy)propyl]cyclopentanamine; oxalic acid CAS Name: N-[3-(4-nitrophenoxy)propyl]cyclopentanamine; oxalic acid IUPAC Name: N-[3-(4-nitrophenoxy)propyl]cyclopentanamine; oxalic acid Traditional Name: cyclopentyl-[3-(4-nitrophenoxy)propyl]amine; oxalic acid Formula: C16H22N2O7 MolecularWeight: 354.35508

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NCCCOC2=CC=C(C=C2)[N+](=O)[O-].C(=O)(C(=O)O)O

Isomeric SMILES

C1CCC(C1)NCCCOC2=CC=C(C=C2)[N+](=O)[O-].C(=O)(C(=O)O)O

InChI

InChI=1S/C14H20N2O3.C2H2O4/c17-16(18)13-6-8-14(9-7-13)19-11-3-10-15-12-4-1-2-5-12;3-1(4)2(5)6/h6-9,12,15H,1-5,10-11H2;(H,3,4)(H,5,6)