4-[1,3-bis(oxidanylidene)isoindol-2-yl]-5-(2-ethylpiperidin-1-yl)-3-methyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]-5-(2-ethylpiperidin-1-yl)-3-methyl-5-oxidanylidene-pentanoic acid Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)-5-(2-ethyl-1-piperidyl)-3-methyl-5-oxo-pentanoic acid CAS Name: 4-(1,3-dioxo-2-isoindolyl)-5-(2-ethyl-1-piperidinyl)-3-methyl-5-oxopentanoic acid IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)-5-(2-ethylpiperidin-1-yl)-3-methyl-5-oxopentanoic acid Traditional Name: 5-(2-ethylpiperidino)-5-keto-3-methyl-4-phthalimido-valeric acid Formula: C21H26N2O5 MolecularWeight: 386.44154

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)C(C(C)CC(=O)O)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCC1CCCCN1C(=O)C(C(C)CC(=O)O)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H26N2O5/c1-3-14-8-6-7-11-22(14)21(28)18(13(2)12-17(24)25)23-19(26)15-9-4-5-10-16(15)20(23)27/h4-5,9-10,13-14,18H,3,6-8,11-12H2,1-2H3,(H,24,25)