1-(4-methylphenyl)sulfonyl-3-(2-phenylethynyl)pyrrole-2-carbaldehyde

Systemtic Name: 1-(4-methylphenyl)sulfonyl-3-(2-phenylethynyl)pyrrole-2-carbaldehyde Openeye Name: 3-(2-phenylethynyl)-1-(p-tolylsulfonyl)pyrrole-2-carbaldehyde CAS Name: 1-(4-methylphenyl)sulfonyl-3-(2-phenylethynyl)-2-pyrrolecarboxaldehyde IUPAC Name: 1-(4-methylphenyl)sulfonyl-3-(2-phenylethynyl)pyrrole-2-carbaldehyde Traditional Name: 3-(2-phenylethynyl)-1-tosyl-pyrrole-2-carbaldehyde Formula: C20H15NO3S MolecularWeight: 349.403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C2C=O)C#CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C2C=O)C#CC3=CC=CC=C3

InChI

InChI=1S/C20H15NO3S/c1-16-7-11-19(12-8-16)25(23,24)21-14-13-18(20(21)15-22)10-9-17-5-3-2-4-6-17/h2-8,11-15H,1H3