1-(5-chloranylpyridin-2-yl)-N-(1-methylisoquinolin-5-yl)piperidine-4-carboxamide

Systemtic Name: 1-(5-chloranylpyridin-2-yl)-N-(1-methylisoquinolin-5-yl)piperidine-4-carboxamide Openeye Name: 1-(5-chloro-2-pyridyl)-N-(1-methyl-5-isoquinolyl)piperidine-4-carboxamide CAS Name: 1-(5-chloro-2-pyridinyl)-N-(1-methyl-5-isoquinolinyl)-4-piperidinecarboxamide IUPAC Name: 1-(5-chloropyridin-2-yl)-N-(1-methylisoquinolin-5-yl)piperidine-4-carboxamide Traditional Name: 1-(5-chloro-2-pyridyl)-N-(1-methyl-5-isoquinolyl)isonipecotamide Formula: C21H21ClN4O MolecularWeight: 380.87064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC2=C1C=CC=C2NC(=O)C3CCN(CC3)C4=NC=C(C=C4)Cl

Isomeric SMILES

CC1=NC=CC2=C1C=CC=C2NC(=O)C3CCN(CC3)C4=NC=C(C=C4)Cl

InChI

InChI=1S/C21H21ClN4O/c1-14-17-3-2-4-19(18(17)7-10-23-14)25-21(27)15-8-11-26(12-9-15)20-6-5-16(22)13-24-20/h2-7,10,13,15H,8-9,11-12H2,1H3,(H,25,27)