1-[(5-bromanyl-2-methoxy-phenyl)methyl]-4-propan-2-yl-piperazin-4-ium

Systemtic Name: 1-[(5-bromanyl-2-methoxy-phenyl)methyl]-4-propan-2-yl-piperazin-4-ium Openeye Name: 1-[(5-bromo-2-methoxy-phenyl)methyl]-4-isopropyl-piperazin-4-ium CAS Name: 1-[(5-bromo-2-methoxyphenyl)methyl]-4-propan-2-ylpiperazin-4-ium IUPAC Name: 1-[(5-bromo-2-methoxyphenyl)methyl]-4-propan-2-ylpiperazin-4-ium Traditional Name: 1-(5-bromo-2-methoxy-benzyl)-4-isopropyl-piperazin-4-ium Formula: C15H24BrN2O+ MolecularWeight: 328.26786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCN(CC1)CC2=C(C=CC(=C2)Br)OC

Isomeric SMILES

CC(C)[NH+]1CCN(CC1)CC2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C15H23BrN2O/c1-12(2)18-8-6-17(7-9-18)11-13-10-14(16)4-5-15(13)19-3/h4-5,10,12H,6-9,11H2,1-3H3/p+1