(E)-2-(benzotriazol-1-yl)-3-(4-bromophenyl)prop-2-enoic acid

Systemtic Name: (E)-2-(benzotriazol-1-yl)-3-(4-bromophenyl)prop-2-enoic acid Openeye Name: (E)-2-(benzotriazol-1-yl)-3-(4-bromophenyl)prop-2-enoic acid CAS Name: (E)-2-(1-benzotriazolyl)-3-(4-bromophenyl)-2-propenoic acid IUPAC Name: (E)-2-(benzotriazol-1-yl)-3-(4-bromophenyl)prop-2-enoic acid Traditional Name: (E)-2-(benzotriazol-1-yl)-3-(4-bromophenyl)acrylic acid Formula: C15H10BrN3O2 MolecularWeight: 344.1628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2C(=CC3=CC=C(C=C3)Br)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2/C(=C/C3=CC=C(C=C3)Br)/C(=O)O

InChI

InChI=1S/C15H10BrN3O2/c16-11-7-5-10(6-8-11)9-14(15(20)21)19-13-4-2-1-3-12(13)17-18-19/h1-9H,(H,20,21)/b14-9+