4-[1-azanyl-4-oxidanyl-1,4-bis(oxidanylidene)-3-(2-piperidin-1-ylphenyl)butan-2-yl]benzoic acid

Systemtic Name: 4-[1-azanyl-4-oxidanyl-1,4-bis(oxidanylidene)-3-(2-piperidin-1-ylphenyl)butan-2-yl]benzoic acid Openeye Name: 4-[1-carbamoyl-3-hydroxy-3-oxo-2-[2-(1-piperidyl)phenyl]propyl]benzoic acid CAS Name: 4-[1-amino-4-hydroxy-1,4-dioxo-3-[2-(1-piperidinyl)phenyl]butan-2-yl]benzoic acid IUPAC Name: 4-[1-amino-4-hydroxy-1,4-dioxo-3-(2-piperidin-1-ylphenyl)butan-2-yl]benzoic acid Traditional Name: 4-[1-carbamoyl-3-hydroxy-3-keto-2-(2-piperidinophenyl)propyl]benzoic acid Formula: C22H24N2O5 MolecularWeight: 396.43636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=CC=C2C(C(C3=CC=C(C=C3)C(=O)O)C(=O)N)C(=O)O

Isomeric SMILES

C1CCN(CC1)C2=CC=CC=C2C(C(C3=CC=C(C=C3)C(=O)O)C(=O)N)C(=O)O

InChI

InChI=1S/C22H24N2O5/c23-20(25)18(14-8-10-15(11-9-14)21(26)27)19(22(28)29)16-6-2-3-7-17(16)24-12-4-1-5-13-24/h2-3,6-11,18-19H,1,4-5,12-13H2,(H2,23,25)(H,26,27)(H,28,29)