[1-(1-pentan-3-ylpiperidin-1-ium-4-yl)-1,2,3-triazol-4-yl]-piperidin-1-yl-methanone

Systemtic Name: [1-(1-pentan-3-ylpiperidin-1-ium-4-yl)-1,2,3-triazol-4-yl]-piperidin-1-yl-methanone Openeye Name: [1-[1-(1-ethylpropyl)piperidin-1-ium-4-yl]triazol-4-yl]-(1-piperidyl)methanone CAS Name: [1-(1-pentan-3-yl-4-piperidin-1-iumyl)-4-triazolyl]-(1-piperidinyl)methanone IUPAC Name: [1-(1-pentan-3-ylpiperidin-1-ium-4-yl)triazol-4-yl]-piperidin-1-ylmethanone Traditional Name: [1-[1-(1-ethylpropyl)piperidin-1-ium-4-yl]triazol-4-yl]-piperidino-methanone Formula: C18H32N5O+ MolecularWeight: 334.47958

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)[NH+]1CCC(CC1)N2C=C(N=N2)C(=O)N3CCCCC3

Isomeric SMILES

CCC(CC)[NH+]1CCC(CC1)N2C=C(N=N2)C(=O)N3CCCCC3

InChI

InChI=1S/C18H31N5O/c1-3-15(4-2)21-12-8-16(9-13-21)23-14-17(19-20-23)18(24)22-10-6-5-7-11-22/h14-16H,3-13H2,1-2H3/p+1