1-[5-nitro-6-[4-(phenylmethyl)piperidin-1-yl]pyrimidin-4-yl]-3,4-dihydro-2H-quinoline

Systemtic Name: 1-[5-nitro-6-[4-(phenylmethyl)piperidin-1-yl]pyrimidin-4-yl]-3,4-dihydro-2H-quinoline Openeye Name: 1-[6-(4-benzyl-1-piperidyl)-5-nitro-pyrimidin-4-yl]-3,4-dihydro-2H-quinoline CAS Name: 1-[5-nitro-6-[4-(phenylmethyl)-1-piperidinyl]-4-pyrimidinyl]-3,4-dihydro-2H-quinoline IUPAC Name: 1-[6-(4-benzylpiperidin-1-yl)-5-nitropyrimidin-4-yl]-3,4-dihydro-2H-quinoline Traditional Name: 1-[6-(4-benzylpiperidino)-5-nitro-pyrimidin-4-yl]-3,4-dihydro-2H-quinoline Formula: C25H27N5O2 MolecularWeight: 429.51418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)C3=C(C(=NC=N3)N4CCC(CC4)CC5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)C3=C(C(=NC=N3)N4CCC(CC4)CC5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H27N5O2/c31-30(32)23-24(28-15-12-20(13-16-28)17-19-7-2-1-3-8-19)26-18-27-25(23)29-14-6-10-21-9-4-5-11-22(21)29/h1-5,7-9,11,18,20H,6,10,12-17H2