N,N-dimethyl-2-[1-(phenylsulfonyl)indol-3-yl]ethanamine; ethanedioic acid

Systemtic Name: N,N-dimethyl-2-[1-(phenylsulfonyl)indol-3-yl]ethanamine; ethanedioic acid Openeye Name: 2-[1-(benzenesulfonyl)indol-3-yl]-N,N-dimethyl-ethanamine; oxalic acid CAS Name: 2-[1-(benzenesulfonyl)-3-indolyl]-N,N-dimethylethanamine; oxalic acid IUPAC Name: 2-[1-(benzenesulfonyl)indol-3-yl]-N,N-dimethylethanamine; oxalic acid Traditional Name: 2-(1-besylindol-3-yl)ethyl-dimethyl-amine; oxalic acid Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1=CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CN(C)CCC1=CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H20N2O2S.C2H2O4/c1-19(2)13-12-15-14-20(18-11-7-6-10-17(15)18)23(21,22)16-8-4-3-5-9-16;3-1(4)2(5)6/h3-11,14H,12-13H2,1-2H3;(H,3,4)(H,5,6)