methyl (2S)-2-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[3-(1,3-dioxoisoindolin-2-yl)propanoylamino]-3-phenyl-propanoate CAS Name: (2S)-2-[[3-(1,3-dioxo-2-isoindolyl)-1-oxopropyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[3-(1,3-dioxoisoindol-2-yl)propanoylamino]-3-phenylpropanoate Traditional Name: (2S)-3-phenyl-2-(3-phthalimidopropanoylamino)propionic acid methyl ester Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H20N2O5/c1-28-21(27)17(13-14-7-3-2-4-8-14)22-18(24)11-12-23-19(25)15-9-5-6-10-16(15)20(23)26/h2-10,17H,11-13H2,1H3,(H,22,24)/t17-/m0/s1