N-[[(3R)-1-(2-chloranylpyridin-4-yl)carbonylpiperidin-3-yl]methyl]-3,5-dimethoxy-benzamide

Systemtic Name: N-[[(3R)-1-(2-chloranylpyridin-4-yl)carbonylpiperidin-3-yl]methyl]-3,5-dimethoxy-benzamide Openeye Name: N-[[(3R)-1-(2-chloropyridine-4-carbonyl)-3-piperidyl]methyl]-3,5-dimethoxy-benzamide CAS Name: N-[[(3R)-1-[(2-chloro-4-pyridinyl)-oxomethyl]-3-piperidinyl]methyl]-3,5-dimethoxybenzamide IUPAC Name: N-[[(3R)-1-(2-chloropyridine-4-carbonyl)piperidin-3-yl]methyl]-3,5-dimethoxybenzamide Traditional Name: N-[[(3R)-1-(2-chloroisonicotinoyl)-3-piperidyl]methyl]-3,5-dimethoxy-benzamide Formula: C21H24ClN3O4 MolecularWeight: 417.88596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NCC2CCCN(C2)C(=O)C3=CC(=NC=C3)Cl)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NC[C@H]2CCCN(C2)C(=O)C3=CC(=NC=C3)Cl)OC

InChI

InChI=1S/C21H24ClN3O4/c1-28-17-8-16(9-18(11-17)29-2)20(26)24-12-14-4-3-7-25(13-14)21(27)15-5-6-23-19(22)10-15/h5-6,8-11,14H,3-4,7,12-13H2,1-2H3,(H,24,26)/t14-/m1/s1