ethyl 4-[1-[4-(1,2,4-triazol-1-yl)butanoyl]piperidin-3-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[1-[4-(1,2,4-triazol-1-yl)butanoyl]piperidin-3-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[1-[4-(1,2,4-triazol-1-yl)butanoyl]-3-piperidyl]piperazine-1-carboxylate CAS Name: 4-[1-[1-oxo-4-(1,2,4-triazol-1-yl)butyl]-3-piperidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-[4-(1,2,4-triazol-1-yl)butanoyl]piperidin-3-yl]piperazine-1-carboxylate Traditional Name: 4-[1-[4-(1,2,4-triazol-1-yl)butanoyl]-3-piperidyl]piperazine-1-carboxylic acid ethyl ester Formula: C18H30N6O3 MolecularWeight: 378.4692

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2CCCN(C2)C(=O)CCCN3C=NC=N3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2CCCN(C2)C(=O)CCCN3C=NC=N3

InChI

InChI=1S/C18H30N6O3/c1-2-27-18(26)22-11-9-21(10-12-22)16-5-3-7-23(13-16)17(25)6-4-8-24-15-19-14-20-24/h14-16H,2-13H2,1H3