[1,3-bis(oxidanylidene)isoindol-2-yl]methyl 2-[(4-methoxyphenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl 2-[(4-methoxyphenyl)carbonylamino]-3-methyl-butanoate Openeye Name: (1,3-dioxoisoindolin-2-yl)methyl 2-[(4-methoxybenzoyl)amino]-3-methyl-butanoate CAS Name: 2-[[(4-methoxyphenyl)-oxomethyl]amino]-3-methylbutanoic acid (1,3-dioxo-2-isoindolyl)methyl ester IUPAC Name: (1,3-dioxoisoindol-2-yl)methyl 2-[(4-methoxybenzoyl)amino]-3-methylbutanoate Traditional Name: 3-methyl-2-(p-anisoylamino)butyric acid phthalimidomethyl ester Formula: C22H22N2O6 MolecularWeight: 410.41988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCN1C(=O)C2=CC=CC=C2C1=O)NC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)C(C(=O)OCN1C(=O)C2=CC=CC=C2C1=O)NC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H22N2O6/c1-13(2)18(23-19(25)14-8-10-15(29-3)11-9-14)22(28)30-12-24-20(26)16-6-4-5-7-17(16)21(24)27/h4-11,13,18H,12H2,1-3H3,(H,23,25)