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

Systemtic Name: 2-[[2-(3-methylbutyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]benzoate Openeye Name: 2-[(2-isopentyl-1,3-dioxo-isoindoline-5-carbonyl)amino]benzoate CAS Name: 2-[[[2-(3-methylbutyl)-1,3-dioxo-5-isoindolyl]-oxomethyl]amino]benzoate IUPAC Name: 2-[[2-(3-methylbutyl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoate Traditional Name: 2-[(2-isoamyl-1,3-diketo-isoindoline-5-carbonyl)amino]benzoate Formula: C21H19N2O5- MolecularWeight: 379.38596

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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=C3C(=O)[O-]

Isomeric SMILES

CC(C)CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)[O-]

InChI

InChI=1S/C21H20N2O5/c1-12(2)9-10-23-19(25)14-8-7-13(11-16(14)20(23)26)18(24)22-17-6-4-3-5-15(17)21(27)28/h3-8,11-12H,9-10H2,1-2H3,(H,22,24)(H,27,28)/p-1