(4-bromanyl-2-chloranyl-phenyl) 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate

Systemtic Name: (4-bromanyl-2-chloranyl-phenyl) 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate Openeye Name: (4-bromo-2-chloro-phenyl) 4-(1,3-dioxoisoindolin-2-yl)butanoate CAS Name: 4-(1,3-dioxo-2-isoindolyl)butanoic acid (4-bromo-2-chlorophenyl) ester IUPAC Name: (4-bromo-2-chlorophenyl) 4-(1,3-dioxoisoindol-2-yl)butanoate Traditional Name: 4-phthalimidobutyric acid (4-bromo-2-chloro-phenyl) ester Formula: C18H13BrClNO4 MolecularWeight: 422.65712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(=O)OC3=C(C=C(C=C3)Br)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(=O)OC3=C(C=C(C=C3)Br)Cl

InChI

InChI=1S/C18H13BrClNO4/c19-11-7-8-15(14(20)10-11)25-16(22)6-3-9-21-17(23)12-4-1-2-5-13(12)18(21)24/h1-2,4-5,7-8,10H,3,6,9H2