(3-bromanyl-4-phenylmethoxy-phenyl)methyl-[(1R)-1-phenylethyl]azanium

Systemtic Name: (3-bromanyl-4-phenylmethoxy-phenyl)methyl-[(1R)-1-phenylethyl]azanium Openeye Name: (4-benzyloxy-3-bromo-phenyl)methyl-[(1R)-1-phenylethyl]ammonium CAS Name: (3-bromo-4-phenylmethoxyphenyl)methyl-[(1R)-1-phenylethyl]ammonium IUPAC Name: (3-bromo-4-phenylmethoxyphenyl)methyl-[(1R)-1-phenylethyl]azanium Traditional Name: (4-benzoxy-3-bromo-benzyl)-[(1R)-1-phenylethyl]ammonium Formula: C22H23BrNO+ MolecularWeight: 397.32812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[NH2+]CC2=CC(=C(C=C2)OCC3=CC=CC=C3)Br

Isomeric SMILES

C[C@H](C1=CC=CC=C1)[NH2+]CC2=CC(=C(C=C2)OCC3=CC=CC=C3)Br

InChI

InChI=1S/C22H22BrNO/c1-17(20-10-6-3-7-11-20)24-15-19-12-13-22(21(23)14-19)25-16-18-8-4-2-5-9-18/h2-14,17,24H,15-16H2,1H3/p+1/t17-/m1/s1