4-(2-tert-butyl-4-methyl-phenoxy)butyl-(2-morpholin-4-ium-4-ylethyl)azanium

Systemtic Name: 4-(2-tert-butyl-4-methyl-phenoxy)butyl-(2-morpholin-4-ium-4-ylethyl)azanium Openeye Name: 4-(2-tert-butyl-4-methyl-phenoxy)butyl-(2-morpholin-4-ium-4-ylethyl)ammonium CAS Name: 4-(2-tert-butyl-4-methylphenoxy)butyl-[2-(4-morpholin-4-iumyl)ethyl]ammonium IUPAC Name: 4-(2-tert-butyl-4-methylphenoxy)butyl-(2-morpholin-4-ium-4-ylethyl)azanium Traditional Name: 4-(2-tert-butyl-4-methyl-phenoxy)butyl-(2-morpholin-4-ium-4-ylethyl)ammonium Formula: C21H38N2O2+2 MolecularWeight: 350.53862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCCC[NH2+]CC[NH+]2CCOCC2)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCCCC[NH2+]CC[NH+]2CCOCC2)C(C)(C)C

InChI

InChI=1S/C21H36N2O2/c1-18-7-8-20(19(17-18)21(2,3)4)25-14-6-5-9-22-10-11-23-12-15-24-16-13-23/h7-8,17,22H,5-6,9-16H2,1-4H3/p+2