2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]pent-4-enoylamino]-6-oxidanyl-hexanoic acid

Systemtic Name: 2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]pent-4-enoylamino]-6-oxidanyl-hexanoic acid Openeye Name: 2-[2-(1,3-dioxoisoindolin-2-yl)pent-4-enoylamino]-6-hydroxy-hexanoic acid CAS Name: 2-[[2-(1,3-dioxo-2-isoindolyl)-1-oxopent-4-enyl]amino]-6-hydroxyhexanoic acid IUPAC Name: 2-[2-(1,3-dioxoisoindol-2-yl)pent-4-enoylamino]-6-hydroxyhexanoic acid Traditional Name: 6-hydroxy-2-(2-phthalimidopent-4-enoylamino)hexanoic acid Formula: C19H22N2O6 MolecularWeight: 374.38778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O6/c1-2-7-15(16(23)20-14(19(26)27)10-5-6-11-22)21-17(24)12-8-3-4-9-13(12)18(21)25/h2-4,8-9,14-15,22H,1,5-7,10-11H2,(H,20,23)(H,26,27)