ethanedioic acid; 1-(1-methyl-2-phenyl-indol-3-yl)-2-(4-methylpiperazin-1-yl)ethanone

Systemtic Name: ethanedioic acid; 1-(1-methyl-2-phenyl-indol-3-yl)-2-(4-methylpiperazin-1-yl)ethanone Openeye Name: 1-(1-methyl-2-phenyl-indol-3-yl)-2-(4-methylpiperazin-1-yl)ethanone; oxalic acid CAS Name: 1-(1-methyl-2-phenyl-3-indolyl)-2-(4-methyl-1-piperazinyl)ethanone; oxalic acid IUPAC Name: 1-(1-methyl-2-phenylindol-3-yl)-2-(4-methylpiperazin-1-yl)ethanone; oxalic acid Traditional Name: 1-(1-methyl-2-phenyl-indol-3-yl)-2-(4-methylpiperazino)ethanone; oxalic acid Formula: C24H27N3O5 MolecularWeight: 437.48828

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC(=O)C2=C(N(C3=CC=CC=C32)C)C4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

CN1CCN(CC1)CC(=O)C2=C(N(C3=CC=CC=C32)C)C4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H25N3O.C2H2O4/c1-23-12-14-25(15-13-23)16-20(26)21-18-10-6-7-11-19(18)24(2)22(21)17-8-4-3-5-9-17;3-1(4)2(5)6/h3-11H,12-16H2,1-2H3;(H,3,4)(H,5,6)