3-(phenylmethyl)-1-(1H-1,2,4-triazol-5-yl)pyrrolidine-2,5-dione

Systemtic Name: 3-(phenylmethyl)-1-(1H-1,2,4-triazol-5-yl)pyrrolidine-2,5-dione Openeye Name: 3-benzyl-1-(1H-1,2,4-triazol-5-yl)pyrrolidine-2,5-dione CAS Name: 3-(phenylmethyl)-1-(1H-1,2,4-triazol-5-yl)pyrrolidine-2,5-dione IUPAC Name: 3-benzyl-1-(1H-1,2,4-triazol-5-yl)pyrrolidine-2,5-dione Traditional Name: 3-benzyl-1-(1H-1,2,4-triazol-5-yl)pyrrolidine-2,5-quinone Formula: C13H12N4O2 MolecularWeight: 256.25998

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1=O)C2=NC=NN2)CC3=CC=CC=C3

Isomeric SMILES

C1C(C(=O)N(C1=O)C2=NC=NN2)CC3=CC=CC=C3

InChI

InChI=1S/C13H12N4O2/c18-11-7-10(6-9-4-2-1-3-5-9)12(19)17(11)13-14-8-15-16-13/h1-5,8,10H,6-7H2,(H,14,15,16)