methyl 2-[1-bromanyl-6-(methylamino)naphthalen-2-yl]oxy-3-phenyl-propanoate

Systemtic Name: methyl 2-[1-bromanyl-6-(methylamino)naphthalen-2-yl]oxy-3-phenyl-propanoate Openeye Name: methyl 2-[[1-bromo-6-(methylamino)-2-naphthyl]oxy]-3-phenyl-propanoate CAS Name: 2-[[1-bromo-6-(methylamino)-2-naphthalenyl]oxy]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[1-bromo-6-(methylamino)naphthalen-2-yl]oxy-3-phenylpropanoate Traditional Name: 2-[1-bromo-6-(methylamino)-2-naphthoxy]-3-phenyl-propionic acid methyl ester Formula: C21H20BrNO3 MolecularWeight: 414.2924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC2=C(C=C1)C(=C(C=C2)OC(CC3=CC=CC=C3)C(=O)OC)Br

Isomeric SMILES

CNC1=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