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

Systemtic Name: methyl 4-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]-4-methyl-benzoate CAS Name: 4-methyl-3-[[[2-(3-methylbutyl)-1,3-dioxo-5-isoindolyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-(3-methylbutyl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoate Traditional Name: 3-[(2-isoamyl-1,3-diketo-isoindoline-5-carbonyl)amino]-4-methyl-benzoic acid methyl ester Formula: C23H24N2O5 MolecularWeight: 408.44706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CCC(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CCC(C)C

InChI

InChI=1S/C23H24N2O5/c1-13(2)9-10-25-21(27)17-8-7-15(11-18(17)22(25)28)20(26)24-19-12-16(23(29)30-4)6-5-14(19)3/h5-8,11-13H,9-10H2,1-4H3,(H,24,26)