methyl 5-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-[(4-methanoylphenyl)carbonylamino]pentanoate

Systemtic Name: methyl 5-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-[(4-methanoylphenyl)carbonylamino]pentanoate Openeye Name: methyl 5-(1,3-dioxoisoindolin-2-yl)-2-[(4-formylbenzoyl)amino]pentanoate CAS Name: 5-(1,3-dioxo-2-isoindolyl)-2-[[(4-formylphenyl)-oxomethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl 5-(1,3-dioxoisoindol-2-yl)-2-[(4-formylbenzoyl)amino]pentanoate Traditional Name: 2-[(4-formylbenzoyl)amino]-5-phthalimido-valeric acid methyl ester Formula: C22H20N2O6 MolecularWeight: 408.404

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCCN1C(=O)C2=CC=CC=C2C1=O)NC(=O)C3=CC=C(C=C3)C=O

Isomeric SMILES

COC(=O)C(CCCN1C(=O)C2=CC=CC=C2C1=O)NC(=O)C3=CC=C(C=C3)C=O

InChI

InChI=1S/C22H20N2O6/c1-30-22(29)18(23-19(26)15-10-8-14(13-25)9-11-15)7-4-12-24-20(27)16-5-2-3-6-17(16)21(24)28/h2-3,5-6,8-11,13,18H,4,7,12H2,1H3,(H,23,26)