1-cyclohexa-1,3-dien-1-yl-2-methyl-5-(4-methylsulfonylphenyl)pyrrole

Systemtic Name: 1-cyclohexa-1,3-dien-1-yl-2-methyl-5-(4-methylsulfonylphenyl)pyrrole Openeye Name: 1-cyclohexa-1,3-dien-1-yl-2-methyl-5-(4-methylsulfonylphenyl)pyrrole CAS Name: 1-(1-cyclohexa-1,3-dienyl)-2-methyl-5-(4-methylsulfonylphenyl)pyrrole IUPAC Name: 1-cyclohexa-1,3-dien-1-yl-2-methyl-5-(4-methylsulfonylphenyl)pyrrole Traditional Name: 1-cyclohexa-1,3-dien-1-yl-2-(4-mesylphenyl)-5-methyl-pyrrole Formula: C18H19NO2S MolecularWeight: 313.41396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=CCC2)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=CCC2)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C18H19NO2S/c1-14-8-13-18(19(14)16-6-4-3-5-7-16)15-9-11-17(12-10-15)22(2,20)21/h3-4,6,8-13H,5,7H2,1-2H3