5-(1-chloroethyl)-2-phenyl-1H-1,2,4-triazol-3-one

Systemtic Name: 5-(1-chloroethyl)-2-phenyl-1H-1,2,4-triazol-3-one Openeye Name: 5-(1-chloroethyl)-2-phenyl-1H-1,2,4-triazol-3-one CAS Name: 5-(1-chloroethyl)-2-phenyl-1H-1,2,4-triazol-3-one IUPAC Name: 5-(1-chloroethyl)-2-phenyl-1H-1,2,4-triazol-3-one Traditional Name: 5-(1-chloroethyl)-2-phenyl-1H-1,2,4-triazol-3-one Formula: C10H10ClN3O MolecularWeight: 223.6589

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)N(N1)C2=CC=CC=C2)Cl

Isomeric SMILES

CC(C1=NC(=O)N(N1)C2=CC=CC=C2)Cl

InChI

InChI=1S/C10H10ClN3O/c1-7(11)9-12-10(15)14(13-9)8-5-3-2-4-6-8/h2-7H,1H3,(H,12,13,15)