5-chloranyl-2-(2,5-diethylphenyl)-1-oxidanidyl-benzotriazol-1-ium

Systemtic Name: 5-chloranyl-2-(2,5-diethylphenyl)-1-oxidanidyl-benzotriazol-1-ium Openeye Name: 5-chloro-2-(2,5-diethylphenyl)-1-oxido-benzotriazol-1-ium CAS Name: 5-chloro-2-(2,5-diethylphenyl)-1-oxidobenzotriazol-1-ium IUPAC Name: 5-chloro-2-(2,5-diethylphenyl)-1-oxidobenzotriazol-1-ium Traditional Name: 5-chloro-2-(2,5-diethylphenyl)-1-oxido-benzotriazol-1-ium Formula: C16H16ClN3O MolecularWeight: 301.77074

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)CC)N2N=C3C=C(C=CC3=[N+]2[O-])Cl

Isomeric SMILES

CCC1=CC(=C(C=C1)CC)N2N=C3C=C(C=CC3=[N+]2[O-])Cl

InChI

InChI=1S/C16H16ClN3O/c1-3-11-5-6-12(4-2)16(9-11)19-18-14-10-13(17)7-8-15(14)20(19)21/h5-10H,3-4H2,1-2H3