ethanedioic acid; 3-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]-1H-indole

Systemtic Name: ethanedioic acid; 3-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]-1H-indole Openeye Name: oxalic acid; 3-[[4-(4-pyridylmethyl)piperazin-1-yl]methyl]-1H-indole CAS Name: oxalic acid; 3-[[4-(pyridin-4-ylmethyl)-1-piperazinyl]methyl]-1H-indole IUPAC Name: oxalic acid; 3-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]-1H-indole Traditional Name: oxalic acid; 3-[[4-(4-pyridylmethyl)piperazino]methyl]-1H-indole Formula: C21H24N4O4 MolecularWeight: 396.43966

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=NC=C2)CC3=CNC4=CC=CC=C43.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1CC2=CC=NC=C2)CC3=CNC4=CC=CC=C43.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H22N4.C2H2O4/c1-2-4-19-18(3-1)17(13-21-19)15-23-11-9-22(10-12-23)14-16-5-7-20-8-6-16;3-1(4)2(5)6/h1-8,13,21H,9-12,14-15H2;(H,3,4)(H,5,6)