[3,5-bis(1-chloroethyl)-1,2,4-triazol-1-yl]-phenyl-methanone

Systemtic Name: [3,5-bis(1-chloroethyl)-1,2,4-triazol-1-yl]-phenyl-methanone Openeye Name: [3,5-bis(1-chloroethyl)-1,2,4-triazol-1-yl]-phenyl-methanone CAS Name: [3,5-bis(1-chloroethyl)-1,2,4-triazol-1-yl]-phenylmethanone IUPAC Name: [3,5-bis(1-chloroethyl)-1,2,4-triazol-1-yl]-phenylmethanone Traditional Name: [3,5-bis(1-chloroethyl)-1,2,4-triazol-1-yl]-phenyl-methanone Formula: C13H13Cl2N3O MolecularWeight: 298.16782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN(C(=N1)C(C)Cl)C(=O)C2=CC=CC=C2)Cl

Isomeric SMILES

CC(C1=NN(C(=N1)C(C)Cl)C(=O)C2=CC=CC=C2)Cl

InChI

InChI=1S/C13H13Cl2N3O/c1-8(14)11-16-12(9(2)15)18(17-11)13(19)10-6-4-3-5-7-10/h3-9H,1-2H3