4-(2-cyclohexyl-3-oxidanylidene-1H-isoindol-5-yl)piperazine-1-carboxylic acid

Systemtic Name: 4-(2-cyclohexyl-3-oxidanylidene-1H-isoindol-5-yl)piperazine-1-carboxylic acid Openeye Name: 4-(2-cyclohexyl-3-oxo-isoindolin-5-yl)piperazine-1-carboxylic acid CAS Name: 4-(2-cyclohexyl-3-oxo-1H-isoindol-5-yl)-1-piperazinecarboxylic acid IUPAC Name: 4-(2-cyclohexyl-3-oxo-1H-isoindol-5-yl)piperazine-1-carboxylic acid Traditional Name: 4-(2-cyclohexyl-3-keto-isoindolin-5-yl)piperazine-1-carboxylic acid Formula: C19H25N3O3 MolecularWeight: 343.4201

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC3=C(C2=O)C=C(C=C3)N4CCN(CC4)C(=O)O

Isomeric SMILES

C1CCC(CC1)N2CC3=C(C2=O)C=C(C=C3)N4CCN(CC4)C(=O)O

InChI

InChI=1S/C19H25N3O3/c23-18-17-12-16(20-8-10-21(11-9-20)19(24)25)7-6-14(17)13-22(18)15-4-2-1-3-5-15/h6-7,12,15H,1-5,8-11,13H2,(H,24,25)