4-[1,3-bis(oxidanylidene)isoindol-2-yl]-5-(6-ethyl-1,2-diazinan-1-yl)-3-methyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]-5-(6-ethyl-1,2-diazinan-1-yl)-3-methyl-5-oxidanylidene-pentanoic acid Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)-5-(6-ethylhexahydropyridazin-1-yl)-3-methyl-5-oxo-pentanoic acid CAS Name: 4-(1,3-dioxo-2-isoindolyl)-5-(6-ethyl-1-diazinanyl)-3-methyl-5-oxopentanoic acid IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)-5-(6-ethyldiazinan-1-yl)-3-methyl-5-oxopentanoic acid Traditional Name: 5-(6-ethylhexahydropyridazin-1-yl)-5-keto-3-methyl-4-phthalimido-valeric acid Formula: C20H25N3O5 MolecularWeight: 387.4296

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCNN1C(=O)C(C(C)CC(=O)O)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCC1CCCNN1C(=O)C(C(C)CC(=O)O)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C20H25N3O5/c1-3-13-7-6-10-21-23(13)20(28)17(12(2)11-16(24)25)22-18(26)14-8-4-5-9-15(14)19(22)27/h4-5,8-9,12-13,17,21H,3,6-7,10-11H2,1-2H3,(H,24,25)