N-[1-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)methyl]piperidin-1-ium-4-yl]-2-methyl-benzamide

Systemtic Name: N-[1-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)methyl]piperidin-1-ium-4-yl]-2-methyl-benzamide Openeye Name: N-[1-[(1-tert-butyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]-2-methyl-benzamide CAS Name: N-[1-[(1-tert-butyl-5-tetrazolyl)methyl]-4-piperidin-1-iumyl]-2-methylbenzamide IUPAC Name: N-[1-[(1-tert-butyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]-2-methylbenzamide Traditional Name: N-[1-[(1-tert-butyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]-2-methyl-benzamide Formula: C19H29N6O+ MolecularWeight: 357.47316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2CC[NH+](CC2)CC3=NN=NN3C(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2CC[NH+](CC2)CC3=NN=NN3C(C)(C)C

InChI

InChI=1S/C19H28N6O/c1-14-7-5-6-8-16(14)18(26)20-15-9-11-24(12-10-15)13-17-21-22-23-25(17)19(2,3)4/h5-8,15H,9-13H2,1-4H3,(H,20,26)/p+1