3-(4-fluoranylphenoxy)propyl 2-(3-methoxypropyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: 3-(4-fluoranylphenoxy)propyl 2-(3-methoxypropyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: 3-(4-fluorophenoxy)propyl 2-(3-methoxypropyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(3-methoxypropyl)-1,3-dioxo-5-isoindolecarboxylic acid 3-(4-fluorophenoxy)propyl ester IUPAC Name: 3-(4-fluorophenoxy)propyl 2-(3-methoxypropyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-(3-methoxypropyl)isoindoline-5-carboxylic acid 3-(4-fluorophenoxy)propyl ester Formula: C22H22FNO6 MolecularWeight: 415.411583

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)OCCCOC3=CC=C(C=C3)F

Isomeric SMILES

COCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)OCCCOC3=CC=C(C=C3)F

InChI

InChI=1S/C22H22FNO6/c1-28-11-2-10-24-20(25)18-9-4-15(14-19(18)21(24)26)22(27)30-13-3-12-29-17-7-5-16(23)6-8-17/h4-9,14H,2-3,10-13H2,1H3