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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H31N5O/c1-18(2,3)14-21-11-7-15(8-12-21)23-13-16(19-20-23)17(24)22-9-5-4-6-10-22/h13,15H,4-12,14H2,1-3H3/p+1