3-(4,4-diethoxybutyl)-1-(4-methylphenyl)sulfonyl-indole

Systemtic Name: 3-(4,4-diethoxybutyl)-1-(4-methylphenyl)sulfonyl-indole Openeye Name: 3-(4,4-diethoxybutyl)-1-(p-tolylsulfonyl)indole CAS Name: 3-(4,4-diethoxybutyl)-1-(4-methylphenyl)sulfonylindole IUPAC Name: 3-(4,4-diethoxybutyl)-1-(4-methylphenyl)sulfonylindole Traditional Name: 3-(4,4-diethoxybutyl)-1-tosyl-indole Formula: C23H29NO4S MolecularWeight: 415.54566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CCCC1=CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C)OCC

Isomeric SMILES

CCOC(CCCC1=CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C)OCC

InChI

InChI=1S/C23H29NO4S/c1-4-27-23(28-5-2)12-8-9-19-17-24(22-11-7-6-10-21(19)22)29(25,26)20-15-13-18(3)14-16-20/h6-7,10-11,13-17,23H,4-5,8-9,12H2,1-3H3