5-azanyl-2-(7-butyl-3-oxidanylidene-1H-isoindol-2-yl)-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-(7-butyl-3-oxidanylidene-1H-isoindol-2-yl)-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-(4-butyl-1-oxo-isoindolin-2-yl)-5-oxo-pentanoic acid CAS Name: 5-amino-2-(7-butyl-3-oxo-1H-isoindol-2-yl)-5-oxopentanoic acid IUPAC Name: 5-amino-2-(7-butyl-3-oxo-1H-isoindol-2-yl)-5-oxopentanoic acid Traditional Name: 5-amino-2-(4-butyl-1-keto-isoindolin-2-yl)-5-keto-valeric acid Formula: C17H22N2O4 MolecularWeight: 318.36758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=CC2=C1CN(C2=O)C(CCC(=O)N)C(=O)O

Isomeric SMILES

CCCCC1=CC=CC2=C1CN(C2=O)C(CCC(=O)N)C(=O)O

InChI

InChI=1S/C17H22N2O4/c1-2-3-5-11-6-4-7-12-13(11)10-19(16(12)21)14(17(22)23)8-9-15(18)20/h4,6-7,14H,2-3,5,8-10H2,1H3,(H2,18,20)(H,22,23)