1-[4-(4-bromanyl-2-propan-2-yl-phenoxy)butyl]-4-methyl-piperazin-1-ium

Systemtic Name: 1-[4-(4-bromanyl-2-propan-2-yl-phenoxy)butyl]-4-methyl-piperazin-1-ium Openeye Name: 1-[4-(4-bromo-2-isopropyl-phenoxy)butyl]-4-methyl-piperazin-1-ium CAS Name: 1-[4-(4-bromo-2-propan-2-ylphenoxy)butyl]-4-methylpiperazin-1-ium IUPAC Name: 1-[4-(4-bromo-2-propan-2-ylphenoxy)butyl]-4-methylpiperazin-1-ium Traditional Name: 1-[4-(4-bromo-2-isopropyl-phenoxy)butyl]-4-methyl-piperazin-1-ium Formula: C18H30BrN2O+ MolecularWeight: 370.3476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1)Br)OCCCC[NH+]2CCN(CC2)C

Isomeric SMILES

CC(C)C1=C(C=CC(=C1)Br)OCCCC[NH+]2CCN(CC2)C

InChI

InChI=1S/C18H29BrN2O/c1-15(2)17-14-16(19)6-7-18(17)22-13-5-4-8-21-11-9-20(3)10-12-21/h6-7,14-15H,4-5,8-13H2,1-3H3/p+1