4-azanyl-3-(1-butyl-3-oxidanylidene-1H-isoindol-2-yl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-azanyl-3-(1-butyl-3-oxidanylidene-1H-isoindol-2-yl)-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-3-(1-butyl-3-oxo-isoindolin-2-yl)-4-oxo-butanoic acid CAS Name: 4-amino-3-(1-butyl-3-oxo-1H-isoindol-2-yl)-4-oxobutanoic acid IUPAC Name: 4-amino-3-(1-butyl-3-oxo-1H-isoindol-2-yl)-4-oxobutanoic acid Traditional Name: 4-amino-3-(1-butyl-3-keto-isoindolin-2-yl)-4-keto-butyric acid Formula: C16H20N2O4 MolecularWeight: 304.341

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C2=CC=CC=C2C(=O)N1C(CC(=O)O)C(=O)N

Isomeric SMILES

CCCCC1C2=CC=CC=C2C(=O)N1C(CC(=O)O)C(=O)N

InChI

InChI=1S/C16H20N2O4/c1-2-3-8-12-10-6-4-5-7-11(10)16(22)18(12)13(15(17)21)9-14(19)20/h4-7,12-13H,2-3,8-9H2,1H3,(H2,17,21)(H,19,20)