1-[[4-cyano-4-[6-(dimethylamino)pyridin-2-yl]piperidin-1-yl]methyl]-4-oxidanylidene-quinolizine-3-carboxylic acid

Systemtic Name: 1-[[4-cyano-4-[6-(dimethylamino)pyridin-2-yl]piperidin-1-yl]methyl]-4-oxidanylidene-quinolizine-3-carboxylic acid Openeye Name: 1-[[4-cyano-4-[6-(dimethylamino)-2-pyridyl]-1-piperidyl]methyl]-4-oxo-quinolizine-3-carboxylic acid CAS Name: 1-[[4-cyano-4-[6-(dimethylamino)-2-pyridinyl]-1-piperidinyl]methyl]-4-oxo-3-quinolizinecarboxylic acid IUPAC Name: 1-[[4-cyano-4-[6-(dimethylamino)pyridin-2-yl]piperidin-1-yl]methyl]-4-oxoquinolizine-3-carboxylic acid Traditional Name: 1-[[4-cyano-4-[6-(dimethylamino)-2-pyridyl]piperidino]methyl]-4-keto-quinolizine-3-carboxylic acid Formula: C24H25N5O3 MolecularWeight: 431.487

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC(=N1)C2(CCN(CC2)CC3=C4C=CC=CN4C(=O)C(=C3)C(=O)O)C#N

Isomeric SMILES

CN(C)C1=CC=CC(=N1)C2(CCN(CC2)CC3=C4C=CC=CN4C(=O)C(=C3)C(=O)O)C#N

InChI

InChI=1S/C24H25N5O3/c1-27(2)21-8-5-7-20(26-21)24(16-25)9-12-28(13-10-24)15-17-14-18(23(31)32)22(30)29-11-4-3-6-19(17)29/h3-8,11,14H,9-10,12-13,15H2,1-2H3,(H,31,32)