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

Systemtic Name: 2-[[4-(4-chlorophenyl)piperazin-1-yl]methyl]-1H-indole; ethanedioic acid Openeye Name: 2-[[4-(4-chlorophenyl)piperazin-1-yl]methyl]-1H-indole; oxalic acid CAS Name: 2-[[4-(4-chlorophenyl)-1-piperazinyl]methyl]-1H-indole; oxalic acid IUPAC Name: 2-[[4-(4-chlorophenyl)piperazin-1-yl]methyl]-1H-indole; oxalic acid Traditional Name: 2-[[4-(4-chlorophenyl)piperazino]methyl]-1H-indole; oxalic acid Formula: C21H22ClN3O4 MolecularWeight: 415.87008

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=CC=CC=C3N2)C4=CC=C(C=C4)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1CC2=CC3=CC=CC=C3N2)C4=CC=C(C=C4)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H20ClN3.C2H2O4/c20-16-5-7-18(8-6-16)23-11-9-22(10-12-23)14-17-13-15-3-1-2-4-19(15)21-17;3-1(4)2(5)6/h1-8,13,21H,9-12,14H2;(H,3,4)(H,5,6)