2-(3-methylphenoxy)ethyl 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate

Systemtic Name: 2-(3-methylphenoxy)ethyl 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate Openeye Name: 2-(3-methylphenoxy)ethyl 4-(1,3-dioxoisoindolin-2-yl)butanoate CAS Name: 4-(1,3-dioxo-2-isoindolyl)butanoic acid 2-(3-methylphenoxy)ethyl ester IUPAC Name: 2-(3-methylphenoxy)ethyl 4-(1,3-dioxoisoindol-2-yl)butanoate Traditional Name: 4-phthalimidobutyric acid 2-(3-methylphenoxy)ethyl ester Formula: C21H21NO5 MolecularWeight: 367.39514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCOC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC(=CC=C1)OCCOC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H21NO5/c1-15-6-4-7-16(14-15)26-12-13-27-19(23)10-5-11-22-20(24)17-8-2-3-9-18(17)21(22)25/h2-4,6-9,14H,5,10-13H2,1H3