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

Systemtic Name: (E)-N-cyclopentyl-2-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]ethenesulfonamide; ethanedioic acid Openeye Name: (E)-N-cyclopentyl-2-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]ethenesulfonamide; oxalic acid CAS Name: (E)-N-cyclopentyl-2-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]ethenesulfonamide; oxalic acid IUPAC Name: (E)-N-cyclopentyl-2-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]ethenesulfonamide; oxalic acid Traditional Name: (E)-N-cyclopentyl-2-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]ethenesulfonamide; oxalic acid Formula: C21H29N3O6S MolecularWeight: 451.53646

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1=CNC2=C1C=C(C=C2)C=CS(=O)(=O)NC3CCCC3.C(=O)(C(=O)O)O

Isomeric SMILES

CN(C)CCC1=CNC2=C1C=C(C=C2)/C=C/S(=O)(=O)NC3CCCC3.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H27N3O2S.C2H2O4/c1-22(2)11-9-16-14-20-19-8-7-15(13-18(16)19)10-12-25(23,24)21-17-5-3-4-6-17;3-1(4)2(5)6/h7-8,10,12-14,17,20-21H,3-6,9,11H2,1-2H3;(H,3,4)(H,5,6)/b12-10+;