3-bromanyl-5-methyl-2-(2-naphthalen-2-yloxyethylamino)benzoic acid

Systemtic Name: 3-bromanyl-5-methyl-2-(2-naphthalen-2-yloxyethylamino)benzoic acid Openeye Name: 3-bromo-5-methyl-2-[2-(2-naphthyloxy)ethylamino]benzoic acid CAS Name: 3-bromo-5-methyl-2-[2-(2-naphthalenyloxy)ethylamino]benzoic acid IUPAC Name: 3-bromo-5-methyl-2-(2-naphthalen-2-yloxyethylamino)benzoic acid Traditional Name: 3-bromo-5-methyl-2-[2-(2-naphthoxy)ethylamino]benzoic acid Formula: C20H18BrNO3 MolecularWeight: 400.26582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(=O)O)NCCOC2=CC3=CC=CC=C3C=C2)Br

Isomeric SMILES

CC1=CC(=C(C(=C1)C(=O)O)NCCOC2=CC3=CC=CC=C3C=C2)Br

InChI

InChI=1S/C20H18BrNO3/c1-13-10-17(20(23)24)19(18(21)11-13)22-8-9-25-16-7-6-14-4-2-3-5-15(14)12-16/h2-7,10-12,22H,8-9H2,1H3,(H,23,24)