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

Systemtic Name: methyl 2-[[2-(3-methylbutyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[(2-isopentyl-1,3-dioxo-isoindoline-5-carbonyl)amino]-3-phenyl-propanoate CAS Name: 2-[[[2-(3-methylbutyl)-1,3-dioxo-5-isoindolyl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[[2-(3-methylbutyl)-1,3-dioxoisoindole-5-carbonyl]amino]-3-phenylpropanoate Traditional Name: 2-[(2-isoamyl-1,3-diketo-isoindoline-5-carbonyl)amino]-3-phenyl-propionic acid methyl ester Formula: C24H26N2O5 MolecularWeight: 422.47364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC(C)CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C24H26N2O5/c1-15(2)11-12-26-22(28)18-10-9-17(14-19(18)23(26)29)21(27)25-20(24(30)31-3)13-16-7-5-4-6-8-16/h4-10,14-15,20H,11-13H2,1-3H3,(H,25,27)