5-dec-1-ynyl-1-(4-methylphenyl)sulfonyl-indole-3-carbaldehyde

Systemtic Name: 5-dec-1-ynyl-1-(4-methylphenyl)sulfonyl-indole-3-carbaldehyde Openeye Name: 5-dec-1-ynyl-1-(p-tolylsulfonyl)indole-3-carbaldehyde CAS Name: 5-dec-1-ynyl-1-(4-methylphenyl)sulfonyl-3-indolecarboxaldehyde IUPAC Name: 5-dec-1-ynyl-1-(4-methylphenyl)sulfonylindole-3-carbaldehyde Traditional Name: 5-dec-1-ynyl-1-tosyl-indole-3-carbaldehyde Formula: C26H29NO3S MolecularWeight: 435.57836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC#CC1=CC2=C(C=C1)N(C=C2C=O)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCCCCCC#CC1=CC2=C(C=C1)N(C=C2C=O)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C26H29NO3S/c1-3-4-5-6-7-8-9-10-11-22-14-17-26-25(18-22)23(20-28)19-27(26)31(29,30)24-15-12-21(2)13-16-24/h12-20H,3-9H2,1-2H3