1-[5-(3-chlorophenyl)-3-ethoxy-1,2,4-triazol-1-yl]butan-1-one

Systemtic Name: 1-[5-(3-chlorophenyl)-3-ethoxy-1,2,4-triazol-1-yl]butan-1-one Openeye Name: 1-[5-(3-chlorophenyl)-3-ethoxy-1,2,4-triazol-1-yl]butan-1-one CAS Name: 1-[5-(3-chlorophenyl)-3-ethoxy-1,2,4-triazol-1-yl]-1-butanone IUPAC Name: 1-[5-(3-chlorophenyl)-3-ethoxy-1,2,4-triazol-1-yl]butan-1-one Traditional Name: 1-[5-(3-chlorophenyl)-3-ethoxy-1,2,4-triazol-1-yl]butan-1-one Formula: C14H16ClN3O2 MolecularWeight: 293.74874

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1C(=NC(=N1)OCC)C2=CC(=CC=C2)Cl

Isomeric SMILES

CCCC(=O)N1C(=NC(=N1)OCC)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C14H16ClN3O2/c1-3-6-12(19)18-13(16-14(17-18)20-4-2)10-7-5-8-11(15)9-10/h5,7-9H,3-4,6H2,1-2H3