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

Systemtic Name: 4-chloranyl-2-[[2-(3-methylbutyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]benzoate Openeye Name: 4-chloro-2-[(2-isopentyl-1,3-dioxo-isoindoline-5-carbonyl)amino]benzoate CAS Name: 4-chloro-2-[[[2-(3-methylbutyl)-1,3-dioxo-5-isoindolyl]-oxomethyl]amino]benzoate IUPAC Name: 4-chloro-2-[[2-(3-methylbutyl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoate Traditional Name: 4-chloro-2-[(2-isoamyl-1,3-diketo-isoindoline-5-carbonyl)amino]benzoate Formula: C21H18ClN2O5- MolecularWeight: 413.83102

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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=C(C=CC(=C3)Cl)C(=O)[O-]

Isomeric SMILES

CC(C)CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=C(C=CC(=C3)Cl)C(=O)[O-]

InChI

InChI=1S/C21H19ClN2O5/c1-11(2)7-8-24-19(26)14-5-3-12(9-16(14)20(24)27)18(25)23-17-10-13(22)4-6-15(17)21(28)29/h3-6,9-11H,7-8H2,1-2H3,(H,23,25)(H,28,29)/p-1