1-(2-chloranyl-3-ethoxy-4-methylsulfonyl-phenyl)-3-cyclopropyl-2-methyl-butan-1-one

Systemtic Name: 1-(2-chloranyl-3-ethoxy-4-methylsulfonyl-phenyl)-3-cyclopropyl-2-methyl-butan-1-one Openeye Name: 1-(2-chloro-3-ethoxy-4-methylsulfonyl-phenyl)-3-cyclopropyl-2-methyl-butan-1-one CAS Name: 1-(2-chloro-3-ethoxy-4-methylsulfonylphenyl)-3-cyclopropyl-2-methyl-1-butanone IUPAC Name: 1-(2-chloro-3-ethoxy-4-methylsulfonylphenyl)-3-cyclopropyl-2-methylbutan-1-one Traditional Name: 1-(2-chloro-3-ethoxy-4-mesyl-phenyl)-3-cyclopropyl-2-methyl-butan-1-one Formula: C17H23ClO4S MolecularWeight: 358.88012

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1Cl)C(=O)C(C)C(C)C2CC2)S(=O)(=O)C

Isomeric SMILES

CCOC1=C(C=CC(=C1Cl)C(=O)C(C)C(C)C2CC2)S(=O)(=O)C

InChI

InChI=1S/C17H23ClO4S/c1-5-22-17-14(23(4,20)21)9-8-13(15(17)18)16(19)11(3)10(2)12-6-7-12/h8-12H,5-7H2,1-4H3