1-[3-(4-tert-butylphenyl)-2-methyl-propyl]-2,5-dimethyl-1-oxidanidyl-piperidin-1-ium

Systemtic Name: 1-[3-(4-tert-butylphenyl)-2-methyl-propyl]-2,5-dimethyl-1-oxidanidyl-piperidin-1-ium Openeye Name: 1-[3-(4-tert-butylphenyl)-2-methyl-propyl]-2,5-dimethyl-1-oxido-piperidin-1-ium CAS Name: 1-[3-(4-tert-butylphenyl)-2-methylpropyl]-2,5-dimethyl-1-oxidopiperidin-1-ium IUPAC Name: 1-[3-(4-tert-butylphenyl)-2-methylpropyl]-2,5-dimethyl-1-oxidopiperidin-1-ium Traditional Name: 1-[3-(4-tert-butylphenyl)-2-methyl-propyl]-2,5-dimethyl-1-oxido-piperidin-1-ium Formula: C21H35NO MolecularWeight: 317.5087

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC([N+](C1)(CC(C)CC2=CC=C(C=C2)C(C)(C)C)[O-])C

Isomeric SMILES

CC1CCC([N+](C1)(CC(C)CC2=CC=C(C=C2)C(C)(C)C)[O-])C

InChI

InChI=1S/C21H35NO/c1-16-7-8-18(3)22(23,14-16)15-17(2)13-19-9-11-20(12-10-19)21(4,5)6/h9-12,16-18H,7-8,13-15H2,1-6H3