ethyl 4-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[4-(1,2,4-triazol-1-ylmethyl)benzoyl]amino]piperidine-1-carboxylate CAS Name: 4-[[oxo-[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[4-(1,2,4-triazol-1-ylmethyl)benzoyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[4-(1,2,4-triazol-1-ylmethyl)benzoyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C18H23N5O3 MolecularWeight: 357.40692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C18H23N5O3/c1-2-26-18(25)22-9-7-16(8-10-22)21-17(24)15-5-3-14(4-6-15)11-23-13-19-12-20-23/h3-6,12-13,16H,2,7-11H2,1H3,(H,21,24)