1,1-bis(benzotriazol-1-yl)butan-2-one

Systemtic Name: 1,1-bis(benzotriazol-1-yl)butan-2-one Openeye Name: 1,1-bis(benzotriazol-1-yl)butan-2-one CAS Name: 1,1-bis(1-benzotriazolyl)-2-butanone IUPAC Name: 1,1-bis(benzotriazol-1-yl)butan-2-one Traditional Name: 1,1-bis(benzotriazol-1-yl)butan-2-one Formula: C16H14N6O MolecularWeight: 306.32196

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(N1C2=CC=CC=C2N=N1)N3C4=CC=CC=C4N=N3

Isomeric SMILES

CCC(=O)C(N1C2=CC=CC=C2N=N1)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C16H14N6O/c1-2-15(23)16(21-13-9-5-3-7-11(13)17-19-21)22-14-10-6-4-8-12(14)18-20-22/h3-10,16H,2H2,1H3