(5-bromanyl-2-methoxy-phenyl)methyl-[(1R)-1,2-diphenylethyl]azanium

Systemtic Name: (5-bromanyl-2-methoxy-phenyl)methyl-[(1R)-1,2-diphenylethyl]azanium Openeye Name: (5-bromo-2-methoxy-phenyl)methyl-[(1R)-1,2-diphenylethyl]ammonium CAS Name: (5-bromo-2-methoxyphenyl)methyl-[(1R)-1,2-diphenylethyl]ammonium IUPAC Name: (5-bromo-2-methoxyphenyl)methyl-[(1R)-1,2-diphenylethyl]azanium Traditional Name: (5-bromo-2-methoxy-benzyl)-[(1R)-1,2-diphenylethyl]ammonium Formula: C22H23BrNO+ MolecularWeight: 397.32812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C[NH2+]C(CC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C[NH2+][C@H](CC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H22BrNO/c1-25-22-13-12-20(23)15-19(22)16-24-21(18-10-6-3-7-11-18)14-17-8-4-2-5-9-17/h2-13,15,21,24H,14,16H2,1H3/p+1/t21-/m1/s1