6-methyl-2-[4-[3-(6-methylpyridin-2-yl)prop-2-ynylidene]piperidin-1-yl]-3-nitro-pyridine

Systemtic Name: 6-methyl-2-[4-[3-(6-methylpyridin-2-yl)prop-2-ynylidene]piperidin-1-yl]-3-nitro-pyridine Openeye Name: 6-methyl-2-[4-[3-(6-methyl-2-pyridyl)prop-2-ynylidene]-1-piperidyl]-3-nitro-pyridine CAS Name: 6-methyl-2-[4-[3-(6-methyl-2-pyridinyl)prop-2-ynylidene]-1-piperidinyl]-3-nitropyridine IUPAC Name: 6-methyl-2-[4-[3-(6-methylpyridin-2-yl)prop-2-ynylidene]piperidin-1-yl]-3-nitropyridine Traditional Name: 6-methyl-2-[4-[3-(6-methyl-2-pyridyl)prop-2-ynylidene]piperidino]-3-nitro-pyridine Formula: C20H20N4O2 MolecularWeight: 348.3984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)[N+](=O)[O-])N2CCC(=CC#CC3=NC(=CC=C3)C)CC2

Isomeric SMILES

CC1=NC(=C(C=C1)[N+](=O)[O-])N2CCC(=CC#CC3=NC(=CC=C3)C)CC2

InChI

InChI=1S/C20H20N4O2/c1-15-5-3-7-18(21-15)8-4-6-17-11-13-23(14-12-17)20-19(24(25)26)10-9-16(2)22-20/h3,5-7,9-10H,11-14H2,1-2H3