2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 4-butoxy-3-ethoxy-benzoate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 4-butoxy-3-ethoxy-benzoate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 4-butoxy-3-ethoxy-benzoate CAS Name: 4-butoxy-3-ethoxybenzoic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 4-butoxy-3-ethoxybenzoate Traditional Name: 4-butoxy-3-ethoxy-benzoic acid 2-phthalimidoethyl ester Formula: C23H25NO6 MolecularWeight: 411.4477

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)OCCN2C(=O)C3=CC=CC=C3C2=O)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)OCCN2C(=O)C3=CC=CC=C3C2=O)OCC

InChI

InChI=1S/C23H25NO6/c1-3-5-13-29-19-11-10-16(15-20(19)28-4-2)23(27)30-14-12-24-21(25)17-8-6-7-9-18(17)22(24)26/h6-11,15H,3-5,12-14H2,1-2H3