4-chloranyl-N-[3-(1,2,4-triazol-1-yl)propyl]benzamide

Systemtic Name: 4-chloranyl-N-[3-(1,2,4-triazol-1-yl)propyl]benzamide Openeye Name: 4-chloro-N-[3-(1,2,4-triazol-1-yl)propyl]benzamide CAS Name: 4-chloro-N-[3-(1,2,4-triazol-1-yl)propyl]benzamide IUPAC Name: 4-chloro-N-[3-(1,2,4-triazol-1-yl)propyl]benzamide Traditional Name: 4-chloro-N-[3-(1,2,4-triazol-1-yl)propyl]benzamide Formula: C12H13ClN4O MolecularWeight: 264.71082

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCCCN2C=NC=N2)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCCCN2C=NC=N2)Cl

InChI

InChI=1S/C12H13ClN4O/c13-11-4-2-10(3-5-11)12(18)15-6-1-7-17-9-14-8-16-17/h2-5,8-9H,1,6-7H2,(H,15,18)