[(S)-(3-bromanyl-4-methoxy-phenyl)-(4-butylcyclohexyl)methyl]azanium

Systemtic Name: [(S)-(3-bromanyl-4-methoxy-phenyl)-(4-butylcyclohexyl)methyl]azanium Openeye Name: [(S)-(3-bromo-4-methoxy-phenyl)-(4-butylcyclohexyl)methyl]ammonium CAS Name: [(S)-(3-bromo-4-methoxyphenyl)-(4-butylcyclohexyl)methyl]ammonium IUPAC Name: [(S)-(3-bromo-4-methoxyphenyl)-(4-butylcyclohexyl)methyl]azanium Traditional Name: [(S)-(3-bromo-4-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=CC(=C(C=C2)OC)Br)[NH3+]

Isomeric SMILES

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

InChI

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