ethanedioic acid; 2-[4-[(4-methylphenyl)methyl]piperazin-1-yl]quinoxaline

Systemtic Name: ethanedioic acid; 2-[4-[(4-methylphenyl)methyl]piperazin-1-yl]quinoxaline Openeye Name: oxalic acid; 2-[4-(p-tolylmethyl)piperazin-1-yl]quinoxaline CAS Name: 2-[4-[(4-methylphenyl)methyl]-1-piperazinyl]quinoxaline; oxalic acid IUPAC Name: 2-[4-[(4-methylphenyl)methyl]piperazin-1-yl]quinoxaline; oxalic acid Traditional Name: 2-[4-(4-methylbenzyl)piperazino]quinoxaline; oxalic acid Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCN(CC2)C3=NC4=CC=CC=C4N=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCN(CC2)C3=NC4=CC=CC=C4N=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H22N4.C2H2O4/c1-16-6-8-17(9-7-16)15-23-10-12-24(13-11-23)20-14-21-18-4-2-3-5-19(18)22-20;3-1(4)2(5)6/h2-9,14H,10-13,15H2,1H3;(H,3,4)(H,5,6)