3-[ethoxy(propylsulfanyl)phosphoryl]oxy-5-methyl-2-(2-methylphenyl)-5-pentyl-cyclohex-2-en-1-one

Systemtic Name: 3-[ethoxy(propylsulfanyl)phosphoryl]oxy-5-methyl-2-(2-methylphenyl)-5-pentyl-cyclohex-2-en-1-one Openeye Name: 3-[ethoxy(propylsulfanyl)phosphoryl]oxy-5-methyl-2-(o-tolyl)-5-pentyl-cyclohex-2-en-1-one CAS Name: 3-[ethoxy-(propylthio)phosphoryl]oxy-5-methyl-2-(2-methylphenyl)-5-pentyl-1-cyclohex-2-enone IUPAC Name: 3-[ethoxy(propylsulfanyl)phosphoryl]oxy-5-methyl-2-(2-methylphenyl)-5-pentylcyclohex-2-en-1-one Traditional Name: 5-amyl-3-[ethoxy-(propylthio)phosphoryl]oxy-5-methyl-2-(o-tolyl)cyclohex-2-en-1-one Formula: C24H37O4PS MolecularWeight: 452.586941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(CC(=C(C(=O)C1)C2=CC=CC=C2C)OP(=O)(OCC)SCCC)C

Isomeric SMILES

CCCCCC1(CC(=C(C(=O)C1)C2=CC=CC=C2C)OP(=O)(OCC)SCCC)C

InChI

InChI=1S/C24H37O4PS/c1-6-9-12-15-24(5)17-21(25)23(20-14-11-10-13-19(20)4)22(18-24)28-29(26,27-8-3)30-16-7-2/h10-11,13-14H,6-9,12,15-18H2,1-5H3