6-(4-methoxy-3-methyl-phenyl)-5-(4-methylsulfonylphenyl)spiro[2.4]hepta-4,6-diene

Systemtic Name: 6-(4-methoxy-3-methyl-phenyl)-5-(4-methylsulfonylphenyl)spiro[2.4]hepta-4,6-diene Openeye Name: 6-(4-methoxy-3-methyl-phenyl)-5-(4-methylsulfonylphenyl)spiro[2.4]hepta-4,6-diene CAS Name: 6-(4-methoxy-3-methylphenyl)-5-(4-methylsulfonylphenyl)spiro[2.4]hepta-4,6-diene IUPAC Name: 6-(4-methoxy-3-methylphenyl)-5-(4-methylsulfonylphenyl)spiro[2.4]hepta-4,6-diene Traditional Name: 5-(4-mesylphenyl)-6-(4-methoxy-3-methyl-phenyl)spiro[2.4]hepta-4,6-diene Formula: C22H22O3S MolecularWeight: 366.47328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC3(CC3)C=C2C4=CC=C(C=C4)S(=O)(=O)C)OC

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC3(CC3)C=C2C4=CC=C(C=C4)S(=O)(=O)C)OC

InChI

InChI=1S/C22H22O3S/c1-15-12-17(6-9-21(15)25-2)20-14-22(10-11-22)13-19(20)16-4-7-18(8-5-16)26(3,23)24/h4-9,12-14H,10-11H2,1-3H3