ethanedioic acid; 5-nitro-N-[4-(3-piperidin-1-ylpropoxy)phenyl]pyridin-2-amine

Systemtic Name: ethanedioic acid; 5-nitro-N-[4-(3-piperidin-1-ylpropoxy)phenyl]pyridin-2-amine Openeye Name: 5-nitro-N-[4-[3-(1-piperidyl)propoxy]phenyl]pyridin-2-amine; oxalic acid CAS Name: 5-nitro-N-[4-[3-(1-piperidinyl)propoxy]phenyl]-2-pyridinamine; oxalic acid IUPAC Name: 5-nitro-N-[4-(3-piperidin-1-ylpropoxy)phenyl]pyridin-2-amine; oxalic acid Traditional Name: (5-nitro-2-pyridyl)-[4-(3-piperidinopropoxy)phenyl]amine; oxalic acid Formula: C23H28N4O11 MolecularWeight: 536.48862

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCOC2=CC=C(C=C2)NC3=NC=C(C=C3)[N+](=O)[O-].C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCN(CC1)CCCOC2=CC=C(C=C2)NC3=NC=C(C=C3)[N+](=O)[O-].C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H24N4O3.2C2H2O4/c24-23(25)17-7-10-19(20-15-17)21-16-5-8-18(9-6-16)26-14-4-13-22-11-2-1-3-12-22;2*3-1(4)2(5)6/h5-10,15H,1-4,11-14H2,(H,20,21);2*(H,3,4)(H,5,6)