3-azanyl-5-[5-[(1-ethylpiperidin-4-yl)amino]pentyl]-1H-pyrazole-4-carbonitrile; ethanedioic acid

Systemtic Name: 3-azanyl-5-[5-[(1-ethylpiperidin-4-yl)amino]pentyl]-1H-pyrazole-4-carbonitrile; ethanedioic acid Openeye Name: 3-amino-5-[5-[(1-ethyl-4-piperidyl)amino]pentyl]-1H-pyrazole-4-carbonitrile; oxalic acid CAS Name: 3-amino-5-[5-[(1-ethyl-4-piperidinyl)amino]pentyl]-1H-pyrazole-4-carbonitrile; oxalic acid IUPAC Name: 3-amino-5-[5-[(1-ethylpiperidin-4-yl)amino]pentyl]-1H-pyrazole-4-carbonitrile; oxalic acid Traditional Name: 3-amino-5-[5-[(1-ethyl-4-piperidyl)amino]pentyl]-1H-pyrazole-4-carbonitrile; oxalic acid Formula: C20H32N6O8 MolecularWeight: 484.50348

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(CC1)NCCCCCC2=C(C(=NN2)N)C#N.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1CCC(CC1)NCCCCCC2=C(C(=NN2)N)C#N.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H28N6.2C2H2O4/c1-2-22-10-7-13(8-11-22)19-9-5-3-4-6-15-14(12-17)16(18)21-20-15;2*3-1(4)2(5)6/h13,19H,2-11H2,1H3,(H3,18,20,21);2*(H,3,4)(H,5,6)