2-azanyl-3-[2-[(2-bromophenyl)methoxycarbonyl]-4-oxidanyl-phenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[2-[(2-bromophenyl)methoxycarbonyl]-4-oxidanyl-phenyl]propanoic acid Openeye Name: 2-amino-3-[2-[(2-bromophenyl)methoxycarbonyl]-4-hydroxy-phenyl]propanoic acid CAS Name: 2-amino-3-[2-[(2-bromophenyl)methoxy-oxomethyl]-4-hydroxyphenyl]propanoic acid IUPAC Name: 2-amino-3-[2-[(2-bromophenyl)methoxycarbonyl]-4-hydroxyphenyl]propanoic acid Traditional Name: 2-amino-3-[2-(2-bromobenzyl)oxycarbonyl-4-hydroxy-phenyl]propionic acid Formula: C17H16BrNO5 MolecularWeight: 394.21664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC(=O)C2=C(C=CC(=C2)O)CC(C(=O)O)N)Br

Isomeric SMILES

C1=CC=C(C(=C1)COC(=O)C2=C(C=CC(=C2)O)CC(C(=O)O)N)Br

InChI

InChI=1S/C17H16BrNO5/c18-14-4-2-1-3-11(14)9-24-17(23)13-8-12(20)6-5-10(13)7-15(19)16(21)22/h1-6,8,15,20H,7,9,19H2,(H,21,22)