3-methyl-2-[4-[3-(6-methylpyridin-2-yl)prop-2-ynylidene]piperidin-1-yl]-5-nitro-pyridine

Systemtic Name: 3-methyl-2-[4-[3-(6-methylpyridin-2-yl)prop-2-ynylidene]piperidin-1-yl]-5-nitro-pyridine Openeye Name: 3-methyl-2-[4-[3-(6-methyl-2-pyridyl)prop-2-ynylidene]-1-piperidyl]-5-nitro-pyridine CAS Name: 3-methyl-2-[4-[3-(6-methyl-2-pyridinyl)prop-2-ynylidene]-1-piperidinyl]-5-nitropyridine IUPAC Name: 3-methyl-2-[4-[3-(6-methylpyridin-2-yl)prop-2-ynylidene]piperidin-1-yl]-5-nitropyridine Traditional Name: 3-methyl-2-[4-[3-(6-methyl-2-pyridyl)prop-2-ynylidene]piperidino]-5-nitro-pyridine Formula: C20H20N4O2 MolecularWeight: 348.3984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=N1)C#CC=C2CCN(CC2)C3=NC=C(C=C3C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=N1)C#CC=C2CCN(CC2)C3=NC=C(C=C3C)[N+](=O)[O-]

InChI

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