4-(4-bromanyl-2-methyl-phenoxy)butyl-(2-methoxyethyl)azanium

Systemtic Name: 4-(4-bromanyl-2-methyl-phenoxy)butyl-(2-methoxyethyl)azanium Openeye Name: 4-(4-bromo-2-methyl-phenoxy)butyl-(2-methoxyethyl)ammonium CAS Name: 4-(4-bromo-2-methylphenoxy)butyl-(2-methoxyethyl)ammonium IUPAC Name: 4-(4-bromo-2-methylphenoxy)butyl-(2-methoxyethyl)azanium Traditional Name: 4-(4-bromo-2-methyl-phenoxy)butyl-(2-methoxyethyl)ammonium Formula: C14H23BrNO2+ MolecularWeight: 317.24192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)OCCCC[NH2+]CCOC

Isomeric SMILES

CC1=C(C=CC(=C1)Br)OCCCC[NH2+]CCOC

InChI

InChI=1S/C14H22BrNO2/c1-12-11-13(15)5-6-14(12)18-9-4-3-7-16-8-10-17-2/h5-6,11,16H,3-4,7-10H2,1-2H3/p+1