[1-[(3S)-1-(3-methylbut-2-enyl)piperidin-1-ium-3-yl]-1,2,3-triazol-4-yl]-piperidin-1-yl-methanone

Systemtic Name: [1-[(3S)-1-(3-methylbut-2-enyl)piperidin-1-ium-3-yl]-1,2,3-triazol-4-yl]-piperidin-1-yl-methanone Openeye Name: [1-[(3S)-1-(3-methylbut-2-enyl)piperidin-1-ium-3-yl]triazol-4-yl]-(1-piperidyl)methanone CAS Name: [1-[(3S)-1-(3-methylbut-2-enyl)-3-piperidin-1-iumyl]-4-triazolyl]-(1-piperidinyl)methanone IUPAC Name: [1-[(3S)-1-(3-methylbut-2-enyl)piperidin-1-ium-3-yl]triazol-4-yl]-piperidin-1-ylmethanone Traditional Name: [1-[(3S)-1-(3-methylbut-2-enyl)piperidin-1-ium-3-yl]triazol-4-yl]-piperidino-methanone Formula: C18H30N5O+ MolecularWeight: 332.4637

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC[NH+]1CCCC(C1)N2C=C(N=N2)C(=O)N3CCCCC3)C

Isomeric SMILES

CC(=CC[NH+]1CCC[C@@H](C1)N2C=C(N=N2)C(=O)N3CCCCC3)C

InChI

InChI=1S/C18H29N5O/c1-15(2)8-12-21-9-6-7-16(13-21)23-14-17(19-20-23)18(24)22-10-4-3-5-11-22/h8,14,16H,3-7,9-13H2,1-2H3/p+1/t16-/m0/s1