5-benzamido-2-[4-[2-(diethylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]benzoic acid

Systemtic Name: 5-benzamido-2-[4-[2-(diethylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]benzoic acid Openeye Name: 5-benzamido-2-[4-[2-(diethylamino)-2-oxo-ethyl]piperazin-1-yl]benzoic acid CAS Name: 5-benzamido-2-[4-[2-(diethylamino)-2-oxoethyl]-1-piperazinyl]benzoic acid IUPAC Name: 5-benzamido-2-[4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl]benzoic acid Traditional Name: 5-benzamido-2-[4-[2-(diethylamino)-2-keto-ethyl]piperazino]benzoic acid Formula: C24H30N4O4 MolecularWeight: 438.5194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCN(CC)C(=O)CN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C24H30N4O4/c1-3-27(4-2)22(29)17-26-12-14-28(15-13-26)21-11-10-19(16-20(21)24(31)32)25-23(30)18-8-6-5-7-9-18/h5-11,16H,3-4,12-15,17H2,1-2H3,(H,25,30)(H,31,32)