N-[2-[4-(diphenylmethylidene)piperidin-1-yl]ethyl]-2,6-dimethyl-3-nitro-pyridin-4-amine dihydrochloride

Systemtic Name: N-[2-[4-(diphenylmethylidene)piperidin-1-yl]ethyl]-2,6-dimethyl-3-nitro-pyridin-4-amine dihydrochloride Openeye Name: N-[2-(4-benzhydrylidene-1-piperidyl)ethyl]-2,6-dimethyl-3-nitro-pyridin-4-amine dihydrochloride CAS Name: N-[2-[4-(diphenylmethylene)-1-piperidinyl]ethyl]-2,6-dimethyl-3-nitro-4-pyridinamine dihydrochloride IUPAC Name: N-[2-(4-benzhydrylidenepiperidin-1-yl)ethyl]-2,6-dimethyl-3-nitropyridin-4-amine dihydrochloride Traditional Name: 2-(4-benzhydrylidenepiperidino)ethyl-(2,6-dimethyl-3-nitro-4-pyridyl)amine dihydrochloride Formula: C27H32Cl2N4O2 MolecularWeight: 515.47458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)NCCN2CCC(=C(C3=CC=CC=C3)C4=CC=CC=C4)CC2)[N+](=O)[O-])C.Cl.Cl

Isomeric SMILES

CC1=NC(=C(C(=C1)NCCN2CCC(=C(C3=CC=CC=C3)C4=CC=CC=C4)CC2)[N+](=O)[O-])C.Cl.Cl

InChI

InChI=1S/C27H30N4O2.2ClH/c1-20-19-25(27(31(32)33)21(2)29-20)28-15-18-30-16-13-24(14-17-30)26(22-9-5-3-6-10-22)23-11-7-4-8-12-23;;/h3-12,19H,13-18H2,1-2H3,(H,28,29);2*1H