1-phenethylbenzotriazole-5-carboxylate

Systemtic Name: 1-phenethylbenzotriazole-5-carboxylate Openeye Name: 1-phenethylbenzotriazole-5-carboxylate CAS Name: 1-phenethyl-5-benzotriazolecarboxylate IUPAC Name: 1-phenethylbenzotriazole-5-carboxylate Traditional Name: 1-phenethylbenzotriazole-5-carboxylate Formula: C15H12N3O2- MolecularWeight: 266.27468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C3=C(C=C(C=C3)C(=O)[O-])N=N2

Isomeric SMILES

C1=CC=C(C=C1)CCN2C3=C(C=C(C=C3)C(=O)[O-])N=N2

InChI

InChI=1S/C15H13N3O2/c19-15(20)12-6-7-14-13(10-12)16-17-18(14)9-8-11-4-2-1-3-5-11/h1-7,10H,8-9H2,(H,19,20)/p-1