1-[3-[(4-chlorophenyl)methyl]-5-oxidanylidene-1H-1,2,4-triazol-4-yl]-3-methyl-pyrrole-2,5-dione

Systemtic Name: 1-[3-[(4-chlorophenyl)methyl]-5-oxidanylidene-1H-1,2,4-triazol-4-yl]-3-methyl-pyrrole-2,5-dione Openeye Name: 1-[3-[(4-chlorophenyl)methyl]-5-oxo-1H-1,2,4-triazol-4-yl]-3-methyl-pyrrole-2,5-dione CAS Name: 1-[3-[(4-chlorophenyl)methyl]-5-oxo-1H-1,2,4-triazol-4-yl]-3-methylpyrrole-2,5-dione IUPAC Name: 1-[3-[(4-chlorophenyl)methyl]-5-oxo-1H-1,2,4-triazol-4-yl]-3-methylpyrrole-2,5-dione Traditional Name: 1-[3-(4-chlorobenzyl)-5-keto-1H-1,2,4-triazol-4-yl]-3-methyl-3-pyrroline-2,5-quinone Formula: C14H11ClN4O3 MolecularWeight: 318.71514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C1=O)N2C(=NNC2=O)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC(=O)N(C1=O)N2C(=NNC2=O)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C14H11ClN4O3/c1-8-6-12(20)19(13(8)21)18-11(16-17-14(18)22)7-9-2-4-10(15)5-3-9/h2-6H,7H2,1H3,(H,17,22)