methyl (2S)-2-[[(2S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]pent-4-enoyl]amino]-6-oxidanyl-hexanoate

Systemtic Name: methyl (2S)-2-[[(2S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]pent-4-enoyl]amino]-6-oxidanyl-hexanoate Openeye Name: methyl (2S)-2-[[(2S)-2-(1,3-dioxoisoindolin-2-yl)pent-4-enoyl]amino]-6-hydroxy-hexanoate CAS Name: (2S)-2-[[(2S)-2-(1,3-dioxo-2-isoindolyl)-1-oxopent-4-enyl]amino]-6-hydroxyhexanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(2S)-2-(1,3-dioxoisoindol-2-yl)pent-4-enoyl]amino]-6-hydroxyhexanoate Traditional Name: (2S)-6-hydroxy-2-[[(2S)-2-phthalimidopent-4-enoyl]amino]hexanoic acid methyl ester Formula: C20H24N2O6 MolecularWeight: 388.41436

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCCCO)NC(=O)C(CC=C)N1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

COC(=O)[C@H](CCCCO)NC(=O)[C@H](CC=C)N1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C20H24N2O6/c1-3-8-16(17(24)21-15(20(27)28-2)11-6-7-12-23)22-18(25)13-9-4-5-10-14(13)19(22)26/h3-5,9-10,15-16,23H,1,6-8,11-12H2,2H3,(H,21,24)/t15-,16-/m0/s1