[4-(3-methyl-5-oxidanylidene-1H-1,2,4-triazol-4-yl)phenyl] piperazine-1-carboxylate

Systemtic Name: [4-(3-methyl-5-oxidanylidene-1H-1,2,4-triazol-4-yl)phenyl] piperazine-1-carboxylate Openeye Name: [4-(3-methyl-5-oxo-1H-1,2,4-triazol-4-yl)phenyl] piperazine-1-carboxylate CAS Name: 1-piperazinecarboxylic acid [4-(3-methyl-5-oxo-1H-1,2,4-triazol-4-yl)phenyl] ester IUPAC Name: [4-(3-methyl-5-oxo-1H-1,2,4-triazol-4-yl)phenyl] piperazine-1-carboxylate Traditional Name: piperazine-1-carboxylic acid [4-(5-keto-3-methyl-1H-1,2,4-triazol-4-yl)phenyl] ester Formula: C14H17N5O3 MolecularWeight: 303.31648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=O)N1C2=CC=C(C=C2)OC(=O)N3CCNCC3

Isomeric SMILES

CC1=NNC(=O)N1C2=CC=C(C=C2)OC(=O)N3CCNCC3

InChI

InChI=1S/C14H17N5O3/c1-10-16-17-13(20)19(10)11-2-4-12(5-3-11)22-14(21)18-8-6-15-7-9-18/h2-5,15H,6-9H2,1H3,(H,17,20)