2-[1-[bis(2-chloroethyloxy)phosphoryl]-2-nitro-ethyl]-5,5-dimethyl-3-oxidanyl-cyclohex-2-en-1-one

Systemtic Name: 2-[1-[bis(2-chloroethyloxy)phosphoryl]-2-nitro-ethyl]-5,5-dimethyl-3-oxidanyl-cyclohex-2-en-1-one Openeye Name: 2-[1-[bis(2-chloroethoxy)phosphoryl]-2-nitro-ethyl]-3-hydroxy-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 2-[1-[bis(2-chloroethoxy)phosphoryl]-2-nitroethyl]-3-hydroxy-5,5-dimethyl-1-cyclohex-2-enone IUPAC Name: 2-[1-[bis(2-chloroethoxy)phosphoryl]-2-nitroethyl]-3-hydroxy-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 2-[1-[bis(2-chloroethoxy)phosphoryl]-2-nitro-ethyl]-3-hydroxy-5,5-dimethyl-cyclohex-2-en-1-one Formula: C14H22Cl2NO7P MolecularWeight: 418.206741

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)C(C[N+](=O)[O-])P(=O)(OCCCl)OCCCl)O)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)C(C[N+](=O)[O-])P(=O)(OCCCl)OCCCl)O)C

InChI

InChI=1S/C14H22Cl2NO7P/c1-14(2)7-10(18)13(11(19)8-14)12(9-17(20)21)25(22,23-5-3-15)24-6-4-16/h12,18H,3-9H2,1-2H3