3-(2-tert-butyl-4-chloranyl-phenoxy)propyl-(3-methoxypropyl)azanium

Systemtic Name: 3-(2-tert-butyl-4-chloranyl-phenoxy)propyl-(3-methoxypropyl)azanium Openeye Name: 3-(2-tert-butyl-4-chloro-phenoxy)propyl-(3-methoxypropyl)ammonium CAS Name: 3-(2-tert-butyl-4-chlorophenoxy)propyl-(3-methoxypropyl)ammonium IUPAC Name: 3-(2-tert-butyl-4-chlorophenoxy)propyl-(3-methoxypropyl)azanium Traditional Name: 3-(2-tert-butyl-4-chloro-phenoxy)propyl-(3-methoxypropyl)ammonium Formula: C17H29ClNO2+ MolecularWeight: 314.87066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)Cl)OCCC[NH2+]CCCOC

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)Cl)OCCC[NH2+]CCCOC

InChI

InChI=1S/C17H28ClNO2/c1-17(2,3)15-13-14(18)7-8-16(15)21-12-6-10-19-9-5-11-20-4/h7-8,13,19H,5-6,9-12H2,1-4H3/p+1