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

Systemtic Name: ethanedioic acid; 3-[[4-(phenylmethyl)piperazin-1-yl]methyl]-1H-indole Openeye Name: 3-[(4-benzylpiperazin-1-yl)methyl]-1H-indole; oxalic acid CAS Name: oxalic acid; 3-[[4-(phenylmethyl)-1-piperazinyl]methyl]-1H-indole IUPAC Name: 3-[(4-benzylpiperazin-1-yl)methyl]-1H-indole; oxalic acid Traditional Name: 3-[(4-benzylpiperazino)methyl]-1H-indole; oxalic acid Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3.C2H2O4/c1-2-6-17(7-3-1)15-22-10-12-23(13-11-22)16-18-14-21-20-9-5-4-8-19(18)20;3-1(4)2(5)6/h1-9,14,21H,10-13,15-16H2;(H,3,4)(H,5,6)