1-[3-(2-dimethylaminoethyl)-1-(phenylcarbonyl)indol-5-yl]-N-methyl-methanesulfonamide; ethanedioic acid

Systemtic Name: 1-[3-(2-dimethylaminoethyl)-1-(phenylcarbonyl)indol-5-yl]-N-methyl-methanesulfonamide; ethanedioic acid Openeye Name: 1-[1-benzoyl-3-(2-dimethylaminoethyl)indol-5-yl]-N-methyl-methanesulfonamide; oxalic acid CAS Name: 1-[1-benzoyl-3-(2-dimethylaminoethyl)-5-indolyl]-N-methylmethanesulfonamide; oxalic acid IUPAC Name: 1-[1-benzoyl-3-(2-dimethylaminoethyl)indol-5-yl]-N-methylmethanesulfonamide; oxalic acid Traditional Name: 1-[1-benzoyl-3-(2-dimethylaminoethyl)indol-5-yl]-N-methyl-methanesulfonamide; oxalic acid Formula: C23H27N3O7S MolecularWeight: 489.54138

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)CC1=CC2=C(C=C1)N(C=C2CCN(C)C)C(=O)C3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CNS(=O)(=O)CC1=CC2=C(C=C1)N(C=C2CCN(C)C)C(=O)C3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H25N3O3S.C2H2O4/c1-22-28(26,27)15-16-9-10-20-19(13-16)18(11-12-23(2)3)14-24(20)21(25)17-7-5-4-6-8-17;3-1(4)2(5)6/h4-10,13-14,22H,11-12,15H2,1-3H3;(H,3,4)(H,5,6)