3-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]-N-methyl-prop-1-ene-2-sulfonamide; ethanedioic acid

Systemtic Name: 3-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]-N-methyl-prop-1-ene-2-sulfonamide; ethanedioic acid Openeye Name: 3-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]-N-methyl-prop-1-ene-2-sulfonamide; oxalic acid CAS Name: 3-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]-N-methyl-1-propene-2-sulfonamide; oxalic acid IUPAC Name: 3-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]-N-methylprop-1-ene-2-sulfonamide; oxalic acid Traditional Name: 3-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]-N-methyl-prop-1-ene-2-sulfonamide; oxalic acid Formula: C18H25N3O6S MolecularWeight: 411.4726

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C(=C)CC1=CC2=C(C=C1)NC=C2CCN(C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CNS(=O)(=O)C(=C)CC1=CC2=C(C=C1)NC=C2CCN(C)C.C(=O)(C(=O)O)O

InChI

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