[3-(2-dimethylaminoethyl)-1H-indol-5-yl] 5-(dimethylamino)naphthalene-1-sulfonate

Systemtic Name: [3-(2-dimethylaminoethyl)-1H-indol-5-yl] 5-(dimethylamino)naphthalene-1-sulfonate Openeye Name: [3-(2-dimethylaminoethyl)-1H-indol-5-yl] 5-(dimethylamino)naphthalene-1-sulfonate CAS Name: 5-(dimethylamino)-1-naphthalenesulfonic acid [3-(2-dimethylaminoethyl)-1H-indol-5-yl] ester IUPAC Name: [3-(2-dimethylaminoethyl)-1H-indol-5-yl] 5-(dimethylamino)naphthalene-1-sulfonate Traditional Name: 5-(dimethylamino)naphthalene-1-sulfonic acid [3-(2-dimethylaminoethyl)-1H-indol-5-yl] ester Formula: C24H27N3O3S MolecularWeight: 437.55448

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1=CNC2=C1C=C(C=C2)OS(=O)(=O)C3=CC=CC4=C3C=CC=C4N(C)C

Isomeric SMILES

CN(C)CCC1=CNC2=C1C=C(C=C2)OS(=O)(=O)C3=CC=CC4=C3C=CC=C4N(C)C

InChI

InChI=1S/C24H27N3O3S/c1-26(2)14-13-17-16-25-22-12-11-18(15-21(17)22)30-31(28,29)24-10-6-7-19-20(24)8-5-9-23(19)27(3)4/h5-12,15-16,25H,13-14H2,1-4H3