[5-bromanyl-6-(1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl)oxy-naphthalen-2-yl]-methyl-azanium

Systemtic Name: [5-bromanyl-6-(1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl)oxy-naphthalen-2-yl]-methyl-azanium Openeye Name: [6-(1-benzyl-2-methoxy-2-oxo-ethoxy)-5-bromo-2-naphthyl]-methyl-ammonium CAS Name: [5-bromo-6-(1-methoxy-1-oxo-3-phenylpropan-2-yl)oxy-2-naphthalenyl]-methylammonium IUPAC Name: [5-bromo-6-(1-methoxy-1-oxo-3-phenylpropan-2-yl)oxynaphthalen-2-yl]-methylazanium Traditional Name: [6-(1-benzyl-2-keto-2-methoxy-ethoxy)-5-bromo-2-naphthyl]-methyl-ammonium Formula: C21H21BrNO3+ MolecularWeight: 415.30034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]C1=CC2=C(C=C1)C(=C(C=C2)OC(CC3=CC=CC=C3)C(=O)OC)Br

Isomeric SMILES

C[NH2+]C1=CC2=C(C=C1)C(=C(C=C2)OC(CC3=CC=CC=C3)C(=O)OC)Br

InChI

InChI=1S/C21H20BrNO3/c1-23-16-9-10-17-15(13-16)8-11-18(20(17)22)26-19(21(24)25-2)12-14-6-4-3-5-7-14/h3-11,13,19,23H,12H2,1-2H3/p+1