5-[3-ethyl-5-methoxy-1-(4-methylphenyl)sulfonyl-indol-2-yl]pent-1-yn-3-ol

Systemtic Name: 5-[3-ethyl-5-methoxy-1-(4-methylphenyl)sulfonyl-indol-2-yl]pent-1-yn-3-ol Openeye Name: 5-[3-ethyl-5-methoxy-1-(p-tolylsulfonyl)indol-2-yl]pent-1-yn-3-ol CAS Name: 5-[3-ethyl-5-methoxy-1-(4-methylphenyl)sulfonyl-2-indolyl]-1-pentyn-3-ol IUPAC Name: 5-[3-ethyl-5-methoxy-1-(4-methylphenyl)sulfonylindol-2-yl]pent-1-yn-3-ol Traditional Name: 5-(3-ethyl-5-methoxy-1-tosyl-indol-2-yl)pent-1-yn-3-ol Formula: C23H25NO4S MolecularWeight: 411.5139

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C2=C1C=C(C=C2)OC)S(=O)(=O)C3=CC=C(C=C3)C)CCC(C#C)O

Isomeric SMILES

CCC1=C(N(C2=C1C=C(C=C2)OC)S(=O)(=O)C3=CC=C(C=C3)C)CCC(C#C)O

InChI

InChI=1S/C23H25NO4S/c1-5-17(25)9-13-22-20(6-2)21-15-18(28-4)10-14-23(21)24(22)29(26,27)19-11-7-16(3)8-12-19/h1,7-8,10-12,14-15,17,25H,6,9,13H2,2-4H3