2-tert-butyl-4-[4-(diphenylmethylidene)-1-(1-oxidanylbutyl)piperidin-1-ium-1-yl]benzene-1,3-diol

Systemtic Name: 2-tert-butyl-4-[4-(diphenylmethylidene)-1-(1-oxidanylbutyl)piperidin-1-ium-1-yl]benzene-1,3-diol Openeye Name: 4-[4-benzhydrylidene-1-(1-hydroxybutyl)piperidin-1-ium-1-yl]-2-tert-butyl-benzene-1,3-diol CAS Name: 2-tert-butyl-4-[4-(diphenylmethylene)-1-(1-hydroxybutyl)-1-piperidin-1-iumyl]benzene-1,3-diol IUPAC Name: 4-[4-benzhydrylidene-1-(1-hydroxybutyl)piperidin-1-ium-1-yl]-2-tert-butylbenzene-1,3-diol Traditional Name: 4-[4-benzhydrylidene-1-(1-hydroxybutyl)piperidin-1-ium-1-yl]-2-tert-butyl-resorcinol Formula: C32H40NO3+ MolecularWeight: 486.6649

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Descriptors Computed from Structure

Canonical SMILES:

CCCC([N+]1(CCC(=C(C2=CC=CC=C2)C3=CC=CC=C3)CC1)C4=C(C(=C(C=C4)O)C(C)(C)C)O)O

Isomeric SMILES

CCCC([N+]1(CCC(=C(C2=CC=CC=C2)C3=CC=CC=C3)CC1)C4=C(C(=C(C=C4)O)C(C)(C)C)O)O

InChI

InChI=1S/C32H39NO3/c1-5-12-28(35)33(26-17-18-27(34)30(31(26)36)32(2,3)4)21-19-25(20-22-33)29(23-13-8-6-9-14-23)24-15-10-7-11-16-24/h6-11,13-18,28,35H,5,12,19-22H2,1-4H3,(H-,34,36)/p+1