4-[4-(2-methoxyphenyl)piperazin-1-yl]carbonylbenzene-1,3-dicarboxylic acid

Systemtic Name: 4-[4-(2-methoxyphenyl)piperazin-1-yl]carbonylbenzene-1,3-dicarboxylic acid Openeye Name: 4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]benzene-1,3-dicarboxylic acid CAS Name: 4-[[4-(2-methoxyphenyl)-1-piperazinyl]-oxomethyl]benzene-1,3-dicarboxylic acid IUPAC Name: 4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]benzene-1,3-dicarboxylic acid Traditional Name: 4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]isophthalic acid Formula: C20H20N2O6 MolecularWeight: 384.3826

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=C(C=C(C=C3)C(=O)O)C(=O)O

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=C(C=C(C=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C20H20N2O6/c1-28-17-5-3-2-4-16(17)21-8-10-22(11-9-21)18(23)14-7-6-13(19(24)25)12-15(14)20(26)27/h2-7,12H,8-11H2,1H3,(H,24,25)(H,26,27)