3-(4-bromophenyl)-3-(3-oxidanylidene-1H-isoindol-2-yl)propanoic acid

Systemtic Name: 3-(4-bromophenyl)-3-(3-oxidanylidene-1H-isoindol-2-yl)propanoic acid Openeye Name: 3-(4-bromophenyl)-3-(1-oxoisoindolin-2-yl)propanoic acid CAS Name: 3-(4-bromophenyl)-3-(3-oxo-1H-isoindol-2-yl)propanoic acid IUPAC Name: 3-(4-bromophenyl)-3-(3-oxo-1H-isoindol-2-yl)propanoic acid Traditional Name: 3-(4-bromophenyl)-3-(1-ketoisoindolin-2-yl)propionic acid Formula: C17H14BrNO3 MolecularWeight: 360.20196

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)N1C(CC(=O)O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1C2=CC=CC=C2C(=O)N1C(CC(=O)O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H14BrNO3/c18-13-7-5-11(6-8-13)15(9-16(20)21)19-10-12-3-1-2-4-14(12)17(19)22/h1-8,15H,9-10H2,(H,20,21)