(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl-(pyridin-3-ylmethyl)azanium

Systemtic Name: (3,5-ditert-butyl-4-oxidanyl-phenyl)methyl-(pyridin-3-ylmethyl)azanium Openeye Name: (3,5-ditert-butyl-4-hydroxy-phenyl)methyl-(3-pyridylmethyl)ammonium CAS Name: (3,5-ditert-butyl-4-hydroxyphenyl)methyl-(3-pyridinylmethyl)ammonium IUPAC Name: (3,5-ditert-butyl-4-hydroxyphenyl)methyl-(pyridin-3-ylmethyl)azanium Traditional Name: (3,5-ditert-butyl-4-hydroxy-benzyl)-(3-pyridylmethyl)ammonium Formula: C21H31N2O+ MolecularWeight: 327.48364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C[NH2+]CC2=CN=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C[NH2+]CC2=CN=CC=C2

InChI

InChI=1S/C21H30N2O/c1-20(2,3)17-10-16(11-18(19(17)24)21(4,5)6)14-23-13-15-8-7-9-22-12-15/h7-12,23-24H,13-14H2,1-6H3/p+1