4-(2-tert-butyl-5-methyl-phenoxy)butyl-(phenylmethyl)azanium

Systemtic Name: 4-(2-tert-butyl-5-methyl-phenoxy)butyl-(phenylmethyl)azanium Openeye Name: benzyl-[4-(2-tert-butyl-5-methyl-phenoxy)butyl]ammonium CAS Name: 4-(2-tert-butyl-5-methylphenoxy)butyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[4-(2-tert-butyl-5-methylphenoxy)butyl]azanium Traditional Name: benzyl-[4-(2-tert-butyl-5-methyl-phenoxy)butyl]ammonium Formula: C22H32NO+ MolecularWeight: 326.49558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)(C)C)OCCCC[NH2+]CC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)(C)C)OCCCC[NH2+]CC2=CC=CC=C2

InChI

InChI=1S/C22H31NO/c1-18-12-13-20(22(2,3)4)21(16-18)24-15-9-8-14-23-17-19-10-6-5-7-11-19/h5-7,10-13,16,23H,8-9,14-15,17H2,1-4H3/p+1