3-azanyl-3-[4-(5-bromanyl-6-oxidanyl-naphthalen-1-yl)-3,5-bis(chloranyl)phenyl]propanoic acid

Systemtic Name: 3-azanyl-3-[4-(5-bromanyl-6-oxidanyl-naphthalen-1-yl)-3,5-bis(chloranyl)phenyl]propanoic acid Openeye Name: 3-amino-3-[4-(5-bromo-6-hydroxy-1-naphthyl)-3,5-dichloro-phenyl]propanoic acid CAS Name: 3-amino-3-[4-(5-bromo-6-hydroxy-1-naphthalenyl)-3,5-dichlorophenyl]propanoic acid IUPAC Name: 3-amino-3-[4-(5-bromo-6-hydroxynaphthalen-1-yl)-3,5-dichlorophenyl]propanoic acid Traditional Name: 3-amino-3-[4-(5-bromo-6-hydroxy-1-naphthyl)-3,5-dichloro-phenyl]propionic acid Formula: C19H14BrCl2NO3 MolecularWeight: 455.12936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2Br)O)C(=C1)C3=C(C=C(C=C3Cl)C(CC(=O)O)N)Cl

Isomeric SMILES

C1=CC2=C(C=CC(=C2Br)O)C(=C1)C3=C(C=C(C=C3Cl)C(CC(=O)O)N)Cl

InChI

InChI=1S/C19H14BrCl2NO3/c20-19-12-3-1-2-11(10(12)4-5-16(19)24)18-13(21)6-9(7-14(18)22)15(23)8-17(25)26/h1-7,15,24H,8,23H2,(H,25,26)