methyl (2R)-3-(1H-indol-3-yl)-2-[4-(3-oxidanylidene-1H-isoindol-2-yl)butanoylamino]propanoate

Systemtic Name: methyl (2R)-3-(1H-indol-3-yl)-2-[4-(3-oxidanylidene-1H-isoindol-2-yl)butanoylamino]propanoate Openeye Name: methyl (2R)-3-(1H-indol-3-yl)-2-[4-(1-oxoisoindolin-2-yl)butanoylamino]propanoate CAS Name: (2R)-3-(1H-indol-3-yl)-2-[[1-oxo-4-(3-oxo-1H-isoindol-2-yl)butyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2R)-3-(1H-indol-3-yl)-2-[4-(3-oxo-1H-isoindol-2-yl)butanoylamino]propanoate Traditional Name: (2R)-3-(1H-indol-3-yl)-2-[4-(1-ketoisoindolin-2-yl)butanoylamino]propionic acid methyl ester Formula: C24H25N3O4 MolecularWeight: 419.473

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)CCCN3CC4=CC=CC=C4C3=O

Isomeric SMILES

COC(=O)[C@@H](CC1=CNC2=CC=CC=C21)NC(=O)CCCN3CC4=CC=CC=C4C3=O

InChI

InChI=1S/C24H25N3O4/c1-31-24(30)21(13-17-14-25-20-10-5-4-8-18(17)20)26-22(28)11-6-12-27-15-16-7-2-3-9-19(16)23(27)29/h2-5,7-10,14,21,25H,6,11-13,15H2,1H3,(H,26,28)/t21-/m1/s1