[(S)-(5-bromanyl-2-methoxy-phenyl)-(4-butylcyclohexyl)methyl]azanium

Systemtic Name: [(S)-(5-bromanyl-2-methoxy-phenyl)-(4-butylcyclohexyl)methyl]azanium Openeye Name: [(S)-(5-bromo-2-methoxy-phenyl)-(4-butylcyclohexyl)methyl]ammonium CAS Name: [(S)-(5-bromo-2-methoxyphenyl)-(4-butylcyclohexyl)methyl]ammonium IUPAC Name: [(S)-(5-bromo-2-methoxyphenyl)-(4-butylcyclohexyl)methyl]azanium Traditional Name: [(S)-(5-bromo-2-methoxy-phenyl)-(4-butylcyclohexyl)methyl]ammonium Formula: C18H29BrNO+ MolecularWeight: 355.33296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(C2=C(C=CC(=C2)Br)OC)[NH3+]

Isomeric SMILES

CCCCC1CCC(CC1)[C@@H](C2=C(C=CC(=C2)Br)OC)[NH3+]

InChI

InChI=1S/C18H28BrNO/c1-3-4-5-13-6-8-14(9-7-13)18(20)16-12-15(19)10-11-17(16)21-2/h10-14,18H,3-9,20H2,1-2H3/p+1/t13?,14?,18-/m0/s1