2-[(3E)-3-ethoxyiminopropyl]-5-[3-(5-methylsulfonylpyridin-2-yl)oxyphenyl]-3-oxidanyl-cyclohex-2-en-1-one

Systemtic Name: 2-[(3E)-3-ethoxyiminopropyl]-5-[3-(5-methylsulfonylpyridin-2-yl)oxyphenyl]-3-oxidanyl-cyclohex-2-en-1-one Openeye Name: 2-[(3E)-3-ethoxyiminopropyl]-3-hydroxy-5-[3-[(5-methylsulfonyl-2-pyridyl)oxy]phenyl]cyclohex-2-en-1-one CAS Name: 2-[(3E)-3-ethoxyiminopropyl]-3-hydroxy-5-[3-[(5-methylsulfonyl-2-pyridinyl)oxy]phenyl]-1-cyclohex-2-enone IUPAC Name: 2-[(3E)-3-ethoxyiminopropyl]-3-hydroxy-5-[3-(5-methylsulfonylpyridin-2-yl)oxyphenyl]cyclohex-2-en-1-one Traditional Name: 2-[(3E)-3-ethyloximinopropyl]-3-hydroxy-5-[3-[(5-mesyl-2-pyridyl)oxy]phenyl]cyclohex-2-en-1-one Formula: C23H26N2O6S MolecularWeight: 458.52734

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Descriptors Computed from Structure

Canonical SMILES:

CCON=CCCC1=C(CC(CC1=O)C2=CC(=CC=C2)OC3=NC=C(C=C3)S(=O)(=O)C)O

Isomeric SMILES

CCO/N=C/CCC1=C(CC(CC1=O)C2=CC(=CC=C2)OC3=NC=C(C=C3)S(=O)(=O)C)O

InChI

InChI=1S/C23H26N2O6S/c1-3-30-25-11-5-8-20-21(26)13-17(14-22(20)27)16-6-4-7-18(12-16)31-23-10-9-19(15-24-23)32(2,28)29/h4,6-7,9-12,15,17,26H,3,5,8,13-14H2,1-2H3/b25-11+