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

Systemtic Name: 3-chloranyl-N-[4-(1,2,4-triazol-1-yl)butyl]benzamide Openeye Name: 3-chloro-N-[4-(1,2,4-triazol-1-yl)butyl]benzamide CAS Name: 3-chloro-N-[4-(1,2,4-triazol-1-yl)butyl]benzamide IUPAC Name: 3-chloro-N-[4-(1,2,4-triazol-1-yl)butyl]benzamide Traditional Name: 3-chloro-N-[4-(1,2,4-triazol-1-yl)butyl]benzamide Formula: C13H15ClN4O MolecularWeight: 278.7374

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C(=O)NCCCCN2C=NC=N2

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C(=O)NCCCCN2C=NC=N2

InChI

InChI=1S/C13H15ClN4O/c14-12-5-3-4-11(8-12)13(19)16-6-1-2-7-18-10-15-9-17-18/h3-5,8-10H,1-2,6-7H2,(H,16,19)