ethanedioic acid; 3-(4-methylpiperazin-1-yl)phenol

Systemtic Name: ethanedioic acid; 3-(4-methylpiperazin-1-yl)phenol Openeye Name: 3-(4-methylpiperazin-1-yl)phenol; oxalic acid CAS Name: 3-(4-methyl-1-piperazinyl)phenol; oxalic acid IUPAC Name: 3-(4-methylpiperazin-1-yl)phenol; oxalic acid Traditional Name: 3-(4-methylpiperazino)phenol; oxalic acid Formula: C13H18N2O5 MolecularWeight: 282.29242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16N2O.C2H2O4/c1-12-5-7-13(8-6-12)10-3-2-4-11(14)9-10;3-1(4)2(5)6/h2-4,9,14H,5-8H2,1H3;(H,3,4)(H,5,6)