(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methyl-[(1R)-1-phenylethyl]azanium

Systemtic Name: (3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methyl-[(1R)-1-phenylethyl]azanium Openeye Name: (3-bromo-4-hydroxy-5-methoxy-phenyl)methyl-[(1R)-1-phenylethyl]ammonium CAS Name: (3-bromo-4-hydroxy-5-methoxyphenyl)methyl-[(1R)-1-phenylethyl]ammonium IUPAC Name: (3-bromo-4-hydroxy-5-methoxyphenyl)methyl-[(1R)-1-phenylethyl]azanium Traditional Name: (3-bromo-4-hydroxy-5-methoxy-benzyl)-[(1R)-1-phenylethyl]ammonium Formula: C16H19BrNO2+ MolecularWeight: 337.23156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[NH2+]CC2=CC(=C(C(=C2)Br)O)OC

Isomeric SMILES

C[C@H](C1=CC=CC=C1)[NH2+]CC2=CC(=C(C(=C2)Br)O)OC

InChI

InChI=1S/C16H18BrNO2/c1-11(13-6-4-3-5-7-13)18-10-12-8-14(17)16(19)15(9-12)20-2/h3-9,11,18-19H,10H2,1-2H3/p+1/t11-/m1/s1