[(S)-(5-bromanyl-3-methyl-1-benzofuran-2-yl)-(2,5-dimethylphenyl)methyl]azanium

Systemtic Name: [(S)-(5-bromanyl-3-methyl-1-benzofuran-2-yl)-(2,5-dimethylphenyl)methyl]azanium Openeye Name: [(S)-(5-bromo-3-methyl-benzofuran-2-yl)-(2,5-dimethylphenyl)methyl]ammonium CAS Name: [(S)-(5-bromo-3-methyl-2-benzofuranyl)-(2,5-dimethylphenyl)methyl]ammonium IUPAC Name: [(S)-(5-bromo-3-methyl-1-benzofuran-2-yl)-(2,5-dimethylphenyl)methyl]azanium Traditional Name: [(S)-(5-bromo-3-methyl-benzofuran-2-yl)-(2,5-dimethylphenyl)methyl]ammonium Formula: C18H19BrNO+ MolecularWeight: 345.25356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(C2=C(C3=C(O2)C=CC(=C3)Br)C)[NH3+]

Isomeric SMILES

CC1=CC(=C(C=C1)C)[C@@H](C2=C(C3=C(O2)C=CC(=C3)Br)C)[NH3+]

InChI

InChI=1S/C18H18BrNO/c1-10-4-5-11(2)14(8-10)17(20)18-12(3)15-9-13(19)6-7-16(15)21-18/h4-9,17H,20H2,1-3H3/p+1/t17-/m0/s1