4-(4-phenylpiperazin-1-yl)carbonylbenzene-1,3-dicarboxylic acid

Systemtic Name: 4-(4-phenylpiperazin-1-yl)carbonylbenzene-1,3-dicarboxylic acid Openeye Name: 4-(4-phenylpiperazine-1-carbonyl)benzene-1,3-dicarboxylic acid CAS Name: 4-[oxo-(4-phenyl-1-piperazinyl)methyl]benzene-1,3-dicarboxylic acid IUPAC Name: 4-(4-phenylpiperazine-1-carbonyl)benzene-1,3-dicarboxylic acid Traditional Name: 4-(4-phenylpiperazine-1-carbonyl)isophthalic acid Formula: C19H18N2O5 MolecularWeight: 354.35662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=C(C=C(C=C3)C(=O)O)C(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=C(C=C(C=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C19H18N2O5/c22-17(15-7-6-13(18(23)24)12-16(15)19(25)26)21-10-8-20(9-11-21)14-4-2-1-3-5-14/h1-7,12H,8-11H2,(H,23,24)(H,25,26)