methyl 5-bromanyl-2-(3-naphthalen-2-yloxypropylamino)benzoate

Systemtic Name: methyl 5-bromanyl-2-(3-naphthalen-2-yloxypropylamino)benzoate Openeye Name: methyl 5-bromo-2-[3-(2-naphthyloxy)propylamino]benzoate CAS Name: 5-bromo-2-[3-(2-naphthalenyloxy)propylamino]benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-(3-naphthalen-2-yloxypropylamino)benzoate Traditional Name: 5-bromo-2-[3-(2-naphthoxy)propylamino]benzoic acid methyl ester Formula: C21H20BrNO3 MolecularWeight: 414.2924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)Br)NCCCOC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)Br)NCCCOC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H20BrNO3/c1-25-21(24)19-14-17(22)8-10-20(19)23-11-4-12-26-18-9-7-15-5-2-3-6-16(15)13-18/h2-3,5-10,13-14,23H,4,11-12H2,1H3