methyl 3-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]-2-methyl-benzoate

Systemtic Name: methyl 3-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]-2-methyl-benzoate Openeye Name: methyl 3-[3-(1,3-dioxoisoindolin-2-yl)propanoylamino]-2-methyl-benzoate CAS Name: 3-[[3-(1,3-dioxo-2-isoindolyl)-1-oxopropyl]amino]-2-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[3-(1,3-dioxoisoindol-2-yl)propanoylamino]-2-methylbenzoate Traditional Name: 2-methyl-3-(3-phthalimidopropanoylamino)benzoic acid methyl ester Formula: C20H18N2O5 MolecularWeight: 366.36732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O)C(=O)OC

InChI

InChI=1S/C20H18N2O5/c1-12-13(20(26)27-2)8-5-9-16(12)21-17(23)10-11-22-18(24)14-6-3-4-7-15(14)19(22)25/h3-9H,10-11H2,1-2H3,(H,21,23)