4-[3,3-dimethyl-5-(4-methylsulfonylphenyl)cyclopenta-1,4-dien-1-yl]pyridine

Systemtic Name: 4-[3,3-dimethyl-5-(4-methylsulfonylphenyl)cyclopenta-1,4-dien-1-yl]pyridine Openeye Name: 4-[3,3-dimethyl-5-(4-methylsulfonylphenyl)cyclopenta-1,4-dien-1-yl]pyridine CAS Name: 4-[3,3-dimethyl-5-(4-methylsulfonylphenyl)-1-cyclopenta-1,4-dienyl]pyridine IUPAC Name: 4-[3,3-dimethyl-5-(4-methylsulfonylphenyl)cyclopenta-1,4-dien-1-yl]pyridine Traditional Name: 4-[5-(4-mesylphenyl)-3,3-dimethyl-cyclopenta-1,4-dien-1-yl]pyridine Formula: C19H19NO2S MolecularWeight: 325.42466

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=C(C(=C1)C2=CC=NC=C2)C3=CC=C(C=C3)S(=O)(=O)C)C

Isomeric SMILES

CC1(C=C(C(=C1)C2=CC=NC=C2)C3=CC=C(C=C3)S(=O)(=O)C)C

InChI

InChI=1S/C19H19NO2S/c1-19(2)12-17(18(13-19)15-8-10-20-11-9-15)14-4-6-16(7-5-14)23(3,21)22/h4-13H,1-3H3