4-butyl-4-methoxy-3-(4-methylsulfonylphenyl)-2-phenyl-cyclobut-2-en-1-one

Systemtic Name: 4-butyl-4-methoxy-3-(4-methylsulfonylphenyl)-2-phenyl-cyclobut-2-en-1-one Openeye Name: 4-butyl-4-methoxy-3-(4-methylsulfonylphenyl)-2-phenyl-cyclobut-2-en-1-one CAS Name: 4-butyl-4-methoxy-3-(4-methylsulfonylphenyl)-2-phenyl-1-cyclobut-2-enone IUPAC Name: 4-butyl-4-methoxy-3-(4-methylsulfonylphenyl)-2-phenylcyclobut-2-en-1-one Traditional Name: 4-butyl-3-(4-mesylphenyl)-4-methoxy-2-phenyl-cyclobut-2-en-1-one Formula: C22H24O4S MolecularWeight: 384.48856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(=C(C1=O)C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)C)OC

Isomeric SMILES

CCCCC1(C(=C(C1=O)C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)C)OC

InChI

InChI=1S/C22H24O4S/c1-4-5-15-22(26-2)20(17-11-13-18(14-12-17)27(3,24)25)19(21(22)23)16-9-7-6-8-10-16/h6-14H,4-5,15H2,1-3H3