[(1R)-1-(3-bromanyl-4-methoxy-phenyl)ethyl]-[(3-ethoxy-4-propoxy-phenyl)methyl]azanium

Systemtic Name: [(1R)-1-(3-bromanyl-4-methoxy-phenyl)ethyl]-[(3-ethoxy-4-propoxy-phenyl)methyl]azanium Openeye Name: [(1R)-1-(3-bromo-4-methoxy-phenyl)ethyl]-[(3-ethoxy-4-propoxy-phenyl)methyl]ammonium CAS Name: [(1R)-1-(3-bromo-4-methoxyphenyl)ethyl]-[(3-ethoxy-4-propoxyphenyl)methyl]ammonium IUPAC Name: [(1R)-1-(3-bromo-4-methoxyphenyl)ethyl]-[(3-ethoxy-4-propoxyphenyl)methyl]azanium Traditional Name: [(1R)-1-(3-bromo-4-methoxy-phenyl)ethyl]-(3-ethoxy-4-propoxy-benzyl)ammonium Formula: C21H29BrNO3+ MolecularWeight: 423.36386

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C[NH2+]C(C)C2=CC(=C(C=C2)OC)Br)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C[NH2+][C@H](C)C2=CC(=C(C=C2)OC)Br)OCC

InChI

InChI=1S/C21H28BrNO3/c1-5-11-26-20-9-7-16(12-21(20)25-6-2)14-23-15(3)17-8-10-19(24-4)18(22)13-17/h7-10,12-13,15,23H,5-6,11,14H2,1-4H3/p+1/t15-/m1/s1