1-(2,4-dimethoxyphenyl)sulfonyl-1-(1H-indol-3-yl)-N,N-dimethyl-2-oxidanylidene-3,4-dihydroisoquinolin-2-ium-3-carboxamide

Systemtic Name: 1-(2,4-dimethoxyphenyl)sulfonyl-1-(1H-indol-3-yl)-N,N-dimethyl-2-oxidanylidene-3,4-dihydroisoquinolin-2-ium-3-carboxamide Openeye Name: 1-(2,4-dimethoxyphenyl)sulfonyl-1-(1H-indol-3-yl)-N,N-dimethyl-2-oxo-3,4-dihydroisoquinolin-2-ium-3-carboxamide CAS Name: 1-(2,4-dimethoxyphenyl)sulfonyl-1-(1H-indol-3-yl)-N,N-dimethyl-2-oxo-3,4-dihydroisoquinolin-2-ium-3-carboxamide IUPAC Name: 1-(2,4-dimethoxyphenyl)sulfonyl-1-(1H-indol-3-yl)-N,N-dimethyl-2-oxo-3,4-dihydroisoquinolin-2-ium-3-carboxamide Traditional Name: 1-(2,4-dimethoxyphenyl)sulfonyl-1-(1H-indol-3-yl)-2-keto-N,N-dimethyl-3,4-dihydroisoquinolin-2-ium-3-carboxamide Formula: C28H28N3O6S+ MolecularWeight: 534.60342

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1CC2=CC=CC=C2C([N+]1=O)(C3=CNC4=CC=CC=C43)S(=O)(=O)C5=C(C=C(C=C5)OC)OC

Isomeric SMILES

CN(C)C(=O)C1CC2=CC=CC=C2C([N+]1=O)(C3=CNC4=CC=CC=C43)S(=O)(=O)C5=C(C=C(C=C5)OC)OC

InChI

InChI=1S/C28H28N3O6S/c1-30(2)27(32)24-15-18-9-5-7-11-21(18)28(31(24)33,22-17-29-23-12-8-6-10-20(22)23)38(34,35)26-14-13-19(36-3)16-25(26)37-4/h5-14,16-17,24,29H,15H2,1-4H3/q+1