methyl 3-(1H-indol-3-yl)-2-[2-(3-oxidanylidene-1H-isoindol-2-yl)ethanoylamino]propanoate

Systemtic Name: methyl 3-(1H-indol-3-yl)-2-[2-(3-oxidanylidene-1H-isoindol-2-yl)ethanoylamino]propanoate Openeye Name: methyl 3-(1H-indol-3-yl)-2-[[2-(1-oxoisoindolin-2-yl)acetyl]amino]propanoate CAS Name: 3-(1H-indol-3-yl)-2-[[1-oxo-2-(3-oxo-1H-isoindol-2-yl)ethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(1H-indol-3-yl)-2-[[2-(3-oxo-1H-isoindol-2-yl)acetyl]amino]propanoate Traditional Name: 3-(1H-indol-3-yl)-2-[[2-(1-ketoisoindolin-2-yl)acetyl]amino]propionic acid methyl ester Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)CN3CC4=CC=CC=C4C3=O

Isomeric SMILES

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)CN3CC4=CC=CC=C4C3=O

InChI

InChI=1S/C22H21N3O4/c1-29-22(28)19(10-15-11-23-18-9-5-4-7-16(15)18)24-20(26)13-25-12-14-6-2-3-8-17(14)21(25)27/h2-9,11,19,23H,10,12-13H2,1H3,(H,24,26)