3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]propyl 4-chloranylbenzoate

Systemtic Name: 3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]propyl 4-chloranylbenzoate Openeye Name: 3-(5-bromo-1,3-dioxo-isoindolin-2-yl)propyl 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid 3-(5-bromo-1,3-dioxo-2-isoindolyl)propyl ester IUPAC Name: 3-(5-bromo-1,3-dioxoisoindol-2-yl)propyl 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid 3-(5-bromo-1,3-diketo-isoindolin-2-yl)propyl ester Formula: C18H13BrClNO4 MolecularWeight: 422.65712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCCCN2C(=O)C3=C(C2=O)C=C(C=C3)Br)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCCCN2C(=O)C3=C(C2=O)C=C(C=C3)Br)Cl

InChI

InChI=1S/C18H13BrClNO4/c19-12-4-7-14-15(10-12)17(23)21(16(14)22)8-1-9-25-18(24)11-2-5-13(20)6-3-11/h2-7,10H,1,8-9H2