1-(2,3-dimethylindol-1-yl)-2-(4-ethylpiperazin-1-yl)ethanone; ethanedioic acid

Systemtic Name: 1-(2,3-dimethylindol-1-yl)-2-(4-ethylpiperazin-1-yl)ethanone; ethanedioic acid Openeye Name: 1-(2,3-dimethylindol-1-yl)-2-(4-ethylpiperazin-1-yl)ethanone; oxalic acid CAS Name: 1-(2,3-dimethyl-1-indolyl)-2-(4-ethyl-1-piperazinyl)ethanone; oxalic acid IUPAC Name: 1-(2,3-dimethylindol-1-yl)-2-(4-ethylpiperazin-1-yl)ethanone; oxalic acid Traditional Name: 1-(2,3-dimethylindol-1-yl)-2-(4-ethylpiperazino)ethanone; oxalic acid Formula: C20H27N3O5 MolecularWeight: 389.44548

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC(=O)N2C(=C(C3=CC=CC=C32)C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1CCN(CC1)CC(=O)N2C(=C(C3=CC=CC=C32)C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H25N3O.C2H2O4/c1-4-19-9-11-20(12-10-19)13-18(22)21-15(3)14(2)16-7-5-6-8-17(16)21;3-1(4)2(5)6/h5-8H,4,9-13H2,1-3H3;(H,3,4)(H,5,6)