2-(4-methylpiperazin-1-yl)carbonylterephthalic acid

Systemtic Name: 2-(4-methylpiperazin-1-yl)carbonylterephthalic acid Openeye Name: 2-(4-methylpiperazine-1-carbonyl)terephthalic acid CAS Name: 2-[(4-methyl-1-piperazinyl)-oxomethyl]terephthalic acid IUPAC Name: 2-(4-methylpiperazine-1-carbonyl)terephthalic acid Traditional Name: 2-(4-methylpiperazine-1-carbonyl)terephthalic acid Formula: C14H16N2O5 MolecularWeight: 292.28724

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=C(C=CC(=C2)C(=O)O)C(=O)O

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=C(C=CC(=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C14H16N2O5/c1-15-4-6-16(7-5-15)12(17)11-8-9(13(18)19)2-3-10(11)14(20)21/h2-3,8H,4-7H2,1H3,(H,18,19)(H,20,21)