(E)-2-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]-N,N-dimethyl-ethenesulfonamide; ethanedioic acid

Systemtic Name: (E)-2-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]-N,N-dimethyl-ethenesulfonamide; ethanedioic acid Openeye Name: (E)-2-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]-N,N-dimethyl-ethenesulfonamide; oxalic acid CAS Name: (E)-2-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]-N,N-dimethylethenesulfonamide; oxalic acid IUPAC Name: (E)-2-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]-N,N-dimethylethenesulfonamide; oxalic acid Traditional Name: (E)-2-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]-N,N-dimethyl-ethenesulfonamide; oxalic acid Formula: C18H25N3O6S MolecularWeight: 411.4726

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1=CNC2=C1C=C(C=C2)C=CS(=O)(=O)N(C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CN(C)CCC1=CNC2=C1C=C(C=C2)/C=C/S(=O)(=O)N(C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H23N3O2S.C2H2O4/c1-18(2)9-7-14-12-17-16-6-5-13(11-15(14)16)8-10-22(20,21)19(3)4;3-1(4)2(5)6/h5-6,8,10-12,17H,7,9H2,1-4H3;(H,3,4)(H,5,6)/b10-8+;