[1-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]piperidin-1-ium-4-yl]-piperidin-1-yl-methanone

Systemtic Name: [1-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]piperidin-1-ium-4-yl]-piperidin-1-yl-methanone Openeye Name: [1-[(3,5-ditert-butyl-4-hydroxy-phenyl)methyl]piperidin-1-ium-4-yl]-(1-piperidyl)methanone CAS Name: [1-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-4-piperidin-1-iumyl]-(1-piperidinyl)methanone IUPAC Name: [1-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]piperidin-1-ium-4-yl]-piperidin-1-ylmethanone Traditional Name: [1-(3,5-ditert-butyl-4-hydroxy-benzyl)piperidin-1-ium-4-yl]-piperidino-methanone Formula: C26H43N2O2+ MolecularWeight: 415.63182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C[NH+]2CCC(CC2)C(=O)N3CCCCC3

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C[NH+]2CCC(CC2)C(=O)N3CCCCC3

InChI

InChI=1S/C26H42N2O2/c1-25(2,3)21-16-19(17-22(23(21)29)26(4,5)6)18-27-14-10-20(11-15-27)24(30)28-12-8-7-9-13-28/h16-17,20,29H,7-15,18H2,1-6H3/p+1