3-[4-[(3-aminophenyl)methoxy]-3,5-bis(bromanyl)phenyl]propanoic acid

Systemtic Name: 3-[4-[(3-aminophenyl)methoxy]-3,5-bis(bromanyl)phenyl]propanoic acid Openeye Name: 3-[4-[(3-aminophenyl)methoxy]-3,5-dibromo-phenyl]propanoic acid CAS Name: 3-[4-[(3-aminophenyl)methoxy]-3,5-dibromophenyl]propanoic acid IUPAC Name: 3-[4-[(3-aminophenyl)methoxy]-3,5-dibromophenyl]propanoic acid Traditional Name: 3-[4-(3-aminobenzyl)oxy-3,5-dibromo-phenyl]propionic acid Formula: C16H15Br2NO3 MolecularWeight: 429.1032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N)COC2=C(C=C(C=C2Br)CCC(=O)O)Br

Isomeric SMILES

C1=CC(=CC(=C1)N)COC2=C(C=C(C=C2Br)CCC(=O)O)Br

InChI

InChI=1S/C16H15Br2NO3/c17-13-7-10(4-5-15(20)21)8-14(18)16(13)22-9-11-2-1-3-12(19)6-11/h1-3,6-8H,4-5,9,19H2,(H,20,21)