N-[6-(2-ethylpiperidin-1-yl)-5-nitro-pyrimidin-4-yl]quinolin-8-amine

Systemtic Name: N-[6-(2-ethylpiperidin-1-yl)-5-nitro-pyrimidin-4-yl]quinolin-8-amine Openeye Name: N-[6-(2-ethyl-1-piperidyl)-5-nitro-pyrimidin-4-yl]quinolin-8-amine CAS Name: N-[6-(2-ethyl-1-piperidinyl)-5-nitro-4-pyrimidinyl]-8-quinolinamine IUPAC Name: N-[6-(2-ethylpiperidin-1-yl)-5-nitropyrimidin-4-yl]quinolin-8-amine Traditional Name: [6-(2-ethylpiperidino)-5-nitro-pyrimidin-4-yl]-(8-quinolyl)amine Formula: C20H22N6O2 MolecularWeight: 378.42768

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C2=C(C(=NC=N2)NC3=CC=CC4=C3N=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCC1CCCCN1C2=C(C(=NC=N2)NC3=CC=CC4=C3N=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H22N6O2/c1-2-15-9-3-4-12-25(15)20-18(26(27)28)19(22-13-23-20)24-16-10-5-7-14-8-6-11-21-17(14)16/h5-8,10-11,13,15H,2-4,9,12H2,1H3,(H,22,23,24)