(phenylmethyl) (2S)-2-(benzotriazol-1-ylcarbonyl)-5-oxidanylidene-pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S)-2-(benzotriazol-1-ylcarbonyl)-5-oxidanylidene-pyrrolidine-1-carboxylate Openeye Name: benzyl (2S)-2-(benzotriazole-1-carbonyl)-5-oxo-pyrrolidine-1-carboxylate CAS Name: (2S)-2-[1-benzotriazolyl(oxo)methyl]-5-oxo-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-(benzotriazole-1-carbonyl)-5-oxopyrrolidine-1-carboxylate Traditional Name: (2S)-2-(benzotriazole-1-carbonyl)-5-keto-pyrrolidine-1-carboxylic acid benzyl ester Formula: C19H16N4O4 MolecularWeight: 364.35474

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1C(=O)N2C3=CC=CC=C3N=N2)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CC(=O)N([C@@H]1C(=O)N2C3=CC=CC=C3N=N2)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C19H16N4O4/c24-17-11-10-16(18(25)23-15-9-5-4-8-14(15)20-21-23)22(17)19(26)27-12-13-6-2-1-3-7-13/h1-9,16H,10-12H2/t16-/m0/s1