(3-chlorophenyl)-[4-(1H-indol-3-ylmethyl)piperazin-1-yl]methanone; ethanedioic acid

Systemtic Name: (3-chlorophenyl)-[4-(1H-indol-3-ylmethyl)piperazin-1-yl]methanone; ethanedioic acid Openeye Name: (3-chlorophenyl)-[4-(1H-indol-3-ylmethyl)piperazin-1-yl]methanone; oxalic acid CAS Name: (3-chlorophenyl)-[4-(1H-indol-3-ylmethyl)-1-piperazinyl]methanone; oxalic acid IUPAC Name: (3-chlorophenyl)-[4-(1H-indol-3-ylmethyl)piperazin-1-yl]methanone; oxalic acid Traditional Name: (3-chlorophenyl)-[4-(1H-indol-3-ylmethyl)piperazino]methanone; oxalic acid Formula: C22H22ClN3O5 MolecularWeight: 443.88018

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CNC3=CC=CC=C32)C(=O)C4=CC(=CC=C4)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1CC2=CNC3=CC=CC=C32)C(=O)C4=CC(=CC=C4)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H20ClN3O.C2H2O4/c21-17-5-3-4-15(12-17)20(25)24-10-8-23(9-11-24)14-16-13-22-19-7-2-1-6-18(16)19;3-1(4)2(5)6/h1-7,12-13,22H,8-11,14H2;(H,3,4)(H,5,6)