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

Systemtic Name: 2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]quinoxaline; ethanedioic acid Openeye Name: 2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]quinoxaline; oxalic acid CAS Name: 2-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]quinoxaline; oxalic acid IUPAC Name: 2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]quinoxaline; oxalic acid Traditional Name: 2-[4-(4-chlorobenzyl)piperazino]quinoxaline; oxalic acid Formula: C21H21ClN4O4 MolecularWeight: 428.86884

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)Cl)C3=NC4=CC=CC=C4N=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)Cl)C3=NC4=CC=CC=C4N=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H19ClN4.C2H2O4/c20-16-7-5-15(6-8-16)14-23-9-11-24(12-10-23)19-13-21-17-3-1-2-4-18(17)22-19;3-1(4)2(5)6/h1-8,13H,9-12,14H2;(H,3,4)(H,5,6)