tert-butyl 4-[[2-(1,2,4-triazol-1-yl)phenyl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[2-(1,2,4-triazol-1-yl)phenyl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[2-(1,2,4-triazol-1-yl)phenyl]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[oxo-[2-(1,2,4-triazol-1-yl)anilino]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[2-(1,2,4-triazol-1-yl)phenyl]carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[2-(1,2,4-triazol-1-yl)phenyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C19H25N5O3 MolecularWeight: 371.4335

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NC2=CC=CC=C2N3C=NC=N3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NC2=CC=CC=C2N3C=NC=N3

InChI

InChI=1S/C19H25N5O3/c1-19(2,3)27-18(26)23-10-8-14(9-11-23)17(25)22-15-6-4-5-7-16(15)24-13-20-12-21-24/h4-7,12-14H,8-11H2,1-3H3,(H,22,25)