methyl 3-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoylamino]benzoate

Systemtic Name: methyl 3-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoylamino]benzoate Openeye Name: methyl 3-[4-(1,3-dioxoisoindolin-2-yl)butanoylamino]benzoate CAS Name: 3-[[4-(1,3-dioxo-2-isoindolyl)-1-oxobutyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[4-(1,3-dioxoisoindol-2-yl)butanoylamino]benzoate Traditional Name: 3-(4-phthalimidobutanoylamino)benzoic acid methyl ester Formula: C20H18N2O5 MolecularWeight: 366.36732

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C20H18N2O5/c1-27-20(26)13-6-4-7-14(12-13)21-17(23)10-5-11-22-18(24)15-8-2-3-9-16(15)19(22)25/h2-4,6-9,12H,5,10-11H2,1H3,(H,21,23)