N-(6-chloranyl-2,6-dimethyl-cyclohexa-2,4-dien-1-yl)-N-(1,2,4-triazol-1-ylmethyl)ethanamide

Systemtic Name: N-(6-chloranyl-2,6-dimethyl-cyclohexa-2,4-dien-1-yl)-N-(1,2,4-triazol-1-ylmethyl)ethanamide Openeye Name: N-(6-chloro-2,6-dimethyl-cyclohexa-2,4-dien-1-yl)-N-(1,2,4-triazol-1-ylmethyl)acetamide CAS Name: N-(6-chloro-2,6-dimethyl-1-cyclohexa-2,4-dienyl)-N-(1,2,4-triazol-1-ylmethyl)acetamide IUPAC Name: N-(6-chloro-2,6-dimethylcyclohexa-2,4-dien-1-yl)-N-(1,2,4-triazol-1-ylmethyl)acetamide Traditional Name: N-(6-chloro-2,6-dimethyl-cyclohexa-2,4-dien-1-yl)-N-(1,2,4-triazol-1-ylmethyl)acetamide Formula: C13H17ClN4O MolecularWeight: 280.75328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(C1N(CN2C=NC=N2)C(=O)C)(C)Cl

Isomeric SMILES

CC1=CC=CC(C1N(CN2C=NC=N2)C(=O)C)(C)Cl

InChI

InChI=1S/C13H17ClN4O/c1-10-5-4-6-13(3,14)12(10)18(11(2)19)9-17-8-15-7-16-17/h4-8,12H,9H2,1-3H3