methyl 3-[[2-(3-methylbutyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]benzoate

Systemtic Name: methyl 3-[[2-(3-methylbutyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]benzoate Openeye Name: methyl 3-[(2-isopentyl-1,3-dioxo-isoindoline-5-carbonyl)amino]benzoate CAS Name: 3-[[[2-(3-methylbutyl)-1,3-dioxo-5-isoindolyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(3-methylbutyl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoate Traditional Name: 3-[(2-isoamyl-1,3-diketo-isoindoline-5-carbonyl)amino]benzoic acid methyl ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC=CC(=C3)C(=O)OC

Isomeric SMILES

CC(C)CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC=CC(=C3)C(=O)OC

InChI

InChI=1S/C22H22N2O5/c1-13(2)9-10-24-20(26)17-8-7-14(12-18(17)21(24)27)19(25)23-16-6-4-5-15(11-16)22(28)29-3/h4-8,11-13H,9-10H2,1-3H3,(H,23,25)