ethyl 4-[4-(1,2,4-triazol-1-yl)phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[4-(1,2,4-triazol-1-yl)phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[4-(1,2,4-triazol-1-yl)benzoyl]piperazine-1-carboxylate CAS Name: 4-[oxo-[4-(1,2,4-triazol-1-yl)phenyl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(1,2,4-triazol-1-yl)benzoyl]piperazine-1-carboxylate Traditional Name: 4-[4-(1,2,4-triazol-1-yl)benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C16H19N5O3 MolecularWeight: 329.35376

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)N3C=NC=N3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)N3C=NC=N3

InChI

InChI=1S/C16H19N5O3/c1-2-24-16(23)20-9-7-19(8-10-20)15(22)13-3-5-14(6-4-13)21-12-17-11-18-21/h3-6,11-12H,2,7-10H2,1H3