[1-[1-[(2R)-6-methylhept-5-en-2-yl]piperidin-1-ium-4-yl]-1,2,3-triazol-4-yl]-piperidin-1-yl-methanone

Systemtic Name: [1-[1-[(2R)-6-methylhept-5-en-2-yl]piperidin-1-ium-4-yl]-1,2,3-triazol-4-yl]-piperidin-1-yl-methanone Openeye Name: [1-[1-[(1R)-1,5-dimethylhex-4-enyl]piperidin-1-ium-4-yl]triazol-4-yl]-(1-piperidyl)methanone CAS Name: [1-[1-[(2R)-6-methylhept-5-en-2-yl]-4-piperidin-1-iumyl]-4-triazolyl]-(1-piperidinyl)methanone IUPAC Name: [1-[1-[(2R)-6-methylhept-5-en-2-yl]piperidin-1-ium-4-yl]triazol-4-yl]-piperidin-1-ylmethanone Traditional Name: [1-[1-[(1R)-1,5-dimethylhex-4-enyl]piperidin-1-ium-4-yl]triazol-4-yl]-piperidino-methanone Formula: C21H36N5O+ MolecularWeight: 374.54344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H35N5O/c1-17(2)8-7-9-18(3)24-14-10-19(11-15-24)26-16-20(22-23-26)21(27)25-12-5-4-6-13-25/h8,16,18-19H,4-7,9-15H2,1-3H3/p+1/t18-/m1/s1