[2-[5-(1-bromoethyl)benzotriazol-2-yl]-4-methyl-phenyl] ethanoate

Systemtic Name: [2-[5-(1-bromoethyl)benzotriazol-2-yl]-4-methyl-phenyl] ethanoate Openeye Name: [2-[5-(1-bromoethyl)benzotriazol-2-yl]-4-methyl-phenyl] acetate CAS Name: acetic acid [2-[5-(1-bromoethyl)-2-benzotriazolyl]-4-methylphenyl] ester IUPAC Name: [2-[5-(1-bromoethyl)benzotriazol-2-yl]-4-methylphenyl] acetate Traditional Name: acetic acid [2-[5-(1-bromoethyl)benzotriazol-2-yl]-4-methyl-phenyl] ester Formula: C17H16BrN3O2 MolecularWeight: 374.23184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C)N2N=C3C=CC(=CC3=N2)C(C)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)C)N2N=C3C=CC(=CC3=N2)C(C)Br

InChI

InChI=1S/C17H16BrN3O2/c1-10-4-7-17(23-12(3)22)16(8-10)21-19-14-6-5-13(11(2)18)9-15(14)20-21/h4-9,11H,1-3H3