1-(6-chloranylpyridazin-3-yl)-N-[(2-methylphenyl)methyl]piperidine-3-carboxamide

Systemtic Name: 1-(6-chloranylpyridazin-3-yl)-N-[(2-methylphenyl)methyl]piperidine-3-carboxamide Openeye Name: 1-(6-chloropyridazin-3-yl)-N-(o-tolylmethyl)piperidine-3-carboxamide CAS Name: 1-(6-chloro-3-pyridazinyl)-N-[(2-methylphenyl)methyl]-3-piperidinecarboxamide IUPAC Name: 1-(6-chloropyridazin-3-yl)-N-[(2-methylphenyl)methyl]piperidine-3-carboxamide Traditional Name: 1-(6-chloropyridazin-3-yl)-N-(2-methylbenzyl)nipecotamide Formula: C18H21ClN4O MolecularWeight: 344.83854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)C2CCCN(C2)C3=NN=C(C=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)C2CCCN(C2)C3=NN=C(C=C3)Cl

InChI

InChI=1S/C18H21ClN4O/c1-13-5-2-3-6-14(13)11-20-18(24)15-7-4-10-23(12-15)17-9-8-16(19)21-22-17/h2-3,5-6,8-9,15H,4,7,10-12H2,1H3,(H,20,24)