4-[2,5-bis(2,2-dimethylpropyl)phenoxy]butylazanium

Systemtic Name: 4-[2,5-bis(2,2-dimethylpropyl)phenoxy]butylazanium Openeye Name: 4-[2,5-bis(2,2-dimethylpropyl)phenoxy]butylammonium CAS Name: 4-[2,5-bis(2,2-dimethylpropyl)phenoxy]butylammonium IUPAC Name: 4-[2,5-bis(2,2-dimethylpropyl)phenoxy]butylazanium Traditional Name: 4-(2,5-dineopentylphenoxy)butylammonium Formula: C20H36NO+ MolecularWeight: 306.50594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC1=CC(=C(C=C1)CC(C)(C)C)OCCCC[NH3+]

Isomeric SMILES

CC(C)(C)CC1=CC(=C(C=C1)CC(C)(C)C)OCCCC[NH3+]

InChI

InChI=1S/C20H35NO/c1-19(2,3)14-16-9-10-17(15-20(4,5)6)18(13-16)22-12-8-7-11-21/h9-10,13H,7-8,11-12,14-15,21H2,1-6H3/p+1