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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)[N+](=O)[O-])N2CCCC(=CC#CC3=NC(=CC=C3)C)C2

Isomeric SMILES

CC1=NC(=C(C=C1)[N+](=O)[O-])N2CCC/C(=C/C#CC3=NC(=CC=C3)C)/C2

InChI

InChI=1S/C20H20N4O2/c1-15-6-3-9-18(21-15)10-4-7-17-8-5-13-23(14-17)20-19(24(25)26)12-11-16(2)22-20/h3,6-7,9,11-12H,5,8,13-14H2,1-2H3/b17-7-