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

Systemtic Name: 3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]propyl 3,4,5-triethoxybenzoate Openeye Name: 3-(5-bromo-1,3-dioxo-isoindolin-2-yl)propyl 3,4,5-triethoxybenzoate CAS Name: 3,4,5-triethoxybenzoic acid 3-(5-bromo-1,3-dioxo-2-isoindolyl)propyl ester IUPAC Name: 3-(5-bromo-1,3-dioxoisoindol-2-yl)propyl 3,4,5-triethoxybenzoate Traditional Name: 3,4,5-triethoxybenzoic acid 3-(5-bromo-1,3-diketo-isoindolin-2-yl)propyl ester Formula: C24H26BrNO7 MolecularWeight: 520.36974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OCCCN2C(=O)C3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OCCCN2C(=O)C3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C24H26BrNO7/c1-4-30-19-12-15(13-20(31-5-2)21(19)32-6-3)24(29)33-11-7-10-26-22(27)17-9-8-16(25)14-18(17)23(26)28/h8-9,12-14H,4-7,10-11H2,1-3H3