4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl 2-[(4-methylphenyl)carbonylamino]ethanoate

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl 2-[(4-methylphenyl)carbonylamino]ethanoate Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)butyl 2-[(4-methylbenzoyl)amino]acetate CAS Name: 2-[[(4-methylphenyl)-oxomethyl]amino]acetic acid 4-(1,3-dioxo-2-isoindolyl)butyl ester IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)butyl 2-[(4-methylbenzoyl)amino]acetate Traditional Name: 2-(p-toluoylamino)acetic acid 4-phthalimidobutyl ester Formula: C22H22N2O5 MolecularWeight: 394.42048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NCC(=O)OCCCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NCC(=O)OCCCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C22H22N2O5/c1-15-8-10-16(11-9-15)20(26)23-14-19(25)29-13-5-4-12-24-21(27)17-6-2-3-7-18(17)22(24)28/h2-3,6-11H,4-5,12-14H2,1H3,(H,23,26)