butyl 3-[[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]methylamino]benzoate

Systemtic Name: butyl 3-[[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]methylamino]benzoate Openeye Name: butyl 3-[(5-bromo-1,3-dioxo-isoindolin-2-yl)methylamino]benzoate CAS Name: 3-[(5-bromo-1,3-dioxo-2-isoindolyl)methylamino]benzoic acid butyl ester IUPAC Name: butyl 3-[(5-bromo-1,3-dioxoisoindol-2-yl)methylamino]benzoate Traditional Name: 3-[(5-bromo-1,3-diketo-isoindolin-2-yl)methylamino]benzoic acid butyl ester Formula: C20H19BrN2O4 MolecularWeight: 431.27986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC(=CC=C1)NCN2C(=O)C3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

CCCCOC(=O)C1=CC(=CC=C1)NCN2C(=O)C3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C20H19BrN2O4/c1-2-3-9-27-20(26)13-5-4-6-15(10-13)22-12-23-18(24)16-8-7-14(21)11-17(16)19(23)25/h4-8,10-11,22H,2-3,9,12H2,1H3