4-[3-(4-bromanyl-2-methyl-phenoxy)propyl]morpholin-4-ium

Systemtic Name: 4-[3-(4-bromanyl-2-methyl-phenoxy)propyl]morpholin-4-ium Openeye Name: 4-[3-(4-bromo-2-methyl-phenoxy)propyl]morpholin-4-ium CAS Name: 4-[3-(4-bromo-2-methylphenoxy)propyl]morpholin-4-ium IUPAC Name: 4-[3-(4-bromo-2-methylphenoxy)propyl]morpholin-4-ium Traditional Name: 4-[3-(4-bromo-2-methyl-phenoxy)propyl]morpholin-4-ium Formula: C14H21BrNO2+ MolecularWeight: 315.22604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)OCCC[NH+]2CCOCC2

Isomeric SMILES

CC1=C(C=CC(=C1)Br)OCCC[NH+]2CCOCC2

InChI

InChI=1S/C14H20BrNO2/c1-12-11-13(15)3-4-14(12)18-8-2-5-16-6-9-17-10-7-16/h3-4,11H,2,5-10H2,1H3/p+1