2-[1-(6-methyl-3-nitro-pyridin-2-yl)piperidin-4-yl]-4-(6-methylpyridin-2-yl)but-3-yn-2-ol

Systemtic Name: 2-[1-(6-methyl-3-nitro-pyridin-2-yl)piperidin-4-yl]-4-(6-methylpyridin-2-yl)but-3-yn-2-ol Openeye Name: 2-[1-(6-methyl-3-nitro-2-pyridyl)-4-piperidyl]-4-(6-methyl-2-pyridyl)but-3-yn-2-ol CAS Name: 2-[1-(6-methyl-3-nitro-2-pyridinyl)-4-piperidinyl]-4-(6-methyl-2-pyridinyl)-3-butyn-2-ol IUPAC Name: 2-[1-(6-methyl-3-nitropyridin-2-yl)piperidin-4-yl]-4-(6-methylpyridin-2-yl)but-3-yn-2-ol Traditional Name: 2-[1-(6-methyl-3-nitro-2-pyridyl)-4-piperidyl]-4-(6-methyl-2-pyridyl)but-3-yn-2-ol Formula: C21H24N4O3 MolecularWeight: 380.44026

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N4O3/c1-15-5-4-6-18(22-15)9-12-21(3,26)17-10-13-24(14-11-17)20-19(25(27)28)8-7-16(2)23-20/h4-8,17,26H,10-11,13-14H2,1-3H3