[benzotriazol-1-yl-(4-bromophenyl)methyl] 3-chloranylbenzoate

Systemtic Name: [benzotriazol-1-yl-(4-bromophenyl)methyl] 3-chloranylbenzoate Openeye Name: [benzotriazol-1-yl-(4-bromophenyl)methyl] 3-chlorobenzoate CAS Name: 3-chlorobenzoic acid [1-benzotriazolyl-(4-bromophenyl)methyl] ester IUPAC Name: [benzotriazol-1-yl-(4-bromophenyl)methyl] 3-chlorobenzoate Traditional Name: 3-chlorobenzoic acid [benzotriazol-1-yl-(4-bromophenyl)methyl] ester Formula: C20H13BrClN3O2 MolecularWeight: 442.69312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2C(C3=CC=C(C=C3)Br)OC(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2C(C3=CC=C(C=C3)Br)OC(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H13BrClN3O2/c21-15-10-8-13(9-11-15)19(25-18-7-2-1-6-17(18)23-24-25)27-20(26)14-4-3-5-16(22)12-14/h1-12,19H