1-[1-(2-chlorophenyl)carbonylpiperidin-3-yl]-N-(2-methoxyethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-[1-(2-chlorophenyl)carbonylpiperidin-3-yl]-N-(2-methoxyethyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-[1-(2-chlorobenzoyl)-3-piperidyl]-N-(2-methoxyethyl)triazole-4-carboxamide CAS Name: 1-[1-[(2-chlorophenyl)-oxomethyl]-3-piperidinyl]-N-(2-methoxyethyl)-4-triazolecarboxamide IUPAC Name: 1-[1-(2-chlorobenzoyl)piperidin-3-yl]-N-(2-methoxyethyl)triazole-4-carboxamide Traditional Name: 1-[1-(2-chlorobenzoyl)-3-piperidyl]-N-(2-methoxyethyl)triazole-4-carboxamide Formula: C18H22ClN5O3 MolecularWeight: 391.85198

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C1=CN(N=N1)C2CCCN(C2)C(=O)C3=CC=CC=C3Cl

Isomeric SMILES

COCCNC(=O)C1=CN(N=N1)C2CCCN(C2)C(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C18H22ClN5O3/c1-27-10-8-20-17(25)16-12-24(22-21-16)13-5-4-9-23(11-13)18(26)14-6-2-3-7-15(14)19/h2-3,6-7,12-13H,4-5,8-11H2,1H3,(H,20,25)