(4-aminocarbonylphenyl)methyl 1-ethylbenzotriazole-5-carboxylate

Systemtic Name: (4-aminocarbonylphenyl)methyl 1-ethylbenzotriazole-5-carboxylate Openeye Name: (4-carbamoylphenyl)methyl 1-ethylbenzotriazole-5-carboxylate CAS Name: 1-ethyl-5-benzotriazolecarboxylic acid (4-carbamoylphenyl)methyl ester IUPAC Name: (4-carbamoylphenyl)methyl 1-ethylbenzotriazole-5-carboxylate Traditional Name: 1-ethylbenzotriazole-5-carboxylic acid (4-carbamoylbenzyl) ester Formula: C17H16N4O3 MolecularWeight: 324.33394

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC3=CC=C(C=C3)C(=O)N)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC3=CC=C(C=C3)C(=O)N)N=N1

InChI

InChI=1S/C17H16N4O3/c1-2-21-15-8-7-13(9-14(15)19-20-21)17(23)24-10-11-3-5-12(6-4-11)16(18)22/h3-9H,2,10H2,1H3,(H2,18,22)