bis(2-chloroethyl) phosphate; 3-chloranyl-4-methyl-7-oxidanyl-chromen-2-one

Systemtic Name: bis(2-chloroethyl) phosphate; 3-chloranyl-4-methyl-7-oxidanyl-chromen-2-one Openeye Name: bis(2-chloroethyl) phosphate; 3-chloro-7-hydroxy-4-methyl-chromen-2-one CAS Name: bis(2-chloroethyl) phosphate; 3-chloro-7-hydroxy-4-methyl-1-benzopyran-2-one IUPAC Name: bis(2-chloroethyl) phosphate; 3-chloro-7-hydroxy-4-methylchromen-2-one Traditional Name: bis(2-chloroethyl) phosphate; 3-chloro-7-hydroxy-4-methyl-coumarin Formula: C14H15Cl3O7P- MolecularWeight: 432.597461

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)O)Cl.C(CCl)OP(=O)([O-])OCCCl

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)O)Cl.C(CCl)OP(=O)([O-])OCCCl

InChI

InChI=1S/C10H7ClO3.C4H9Cl2O4P/c1-5-7-3-2-6(12)4-8(7)14-10(13)9(5)11;5-1-3-9-11(7,8)10-4-2-6/h2-4,12H,1H3;1-4H2,(H,7,8)/p-1