[3-chloranyl-5,6-bis(2-chloroethyl)-4-methyl-2-oxidanylidene-chromen-7-yl] dihydrogen phosphate

Systemtic Name: [3-chloranyl-5,6-bis(2-chloroethyl)-4-methyl-2-oxidanylidene-chromen-7-yl] dihydrogen phosphate Openeye Name: [3-chloro-5,6-bis(2-chloroethyl)-4-methyl-2-oxo-chromen-7-yl] dihydrogen phosphate CAS Name: [3-chloro-5,6-bis(2-chloroethyl)-4-methyl-2-oxo-1-benzopyran-7-yl] dihydrogen phosphate IUPAC Name: [3-chloro-5,6-bis(2-chloroethyl)-4-methyl-2-oxochromen-7-yl] dihydrogen phosphate Traditional Name: [3-chloro-5,6-bis(2-chloroethyl)-2-keto-4-methyl-chromen-7-yl] dihydrogen phosphate Formula: C14H14Cl3O6P MolecularWeight: 415.590121

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=C(C(=C12)CCCl)CCCl)OP(=O)(O)O)Cl

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=C(C(=C12)CCCl)CCCl)OP(=O)(O)O)Cl

InChI

InChI=1S/C14H14Cl3O6P/c1-7-12-9(3-5-16)8(2-4-15)10(23-24(19,20)21)6-11(12)22-14(18)13(7)17/h6H,2-5H2,1H3,(H2,19,20,21)