methyl 2-[bis(2-chloroethyl)amino]-2-oxidanylidene-1,3-dihydro-1,3,2$l^{5}-benzodiazaphosphole-5-carboxylate

Systemtic Name: methyl 2-[bis(2-chloroethyl)amino]-2-oxidanylidene-1,3-dihydro-1,3,2$l^{5}-benzodiazaphosphole-5-carboxylate Openeye Name: methyl 2-[bis(2-chloroethyl)amino]-2-oxo-1,3-dihydro-1,3,2$l^{5}-benzodiazaphosphole-5-carboxylate CAS Name: 2-[bis(2-chloroethyl)amino]-2-oxo-1,3-dihydro-1,3,2$l^{5}-benzodiazaphosphole-5-carboxylic acid methyl ester IUPAC Name: methyl 2-[bis(2-chloroethyl)amino]-2-oxo-1,3-dihydro-1,3,2$l^{5}-benzodiazaphosphole-5-carboxylate Traditional Name: 2-[bis(2-chloroethyl)amino]-2-keto-1,3-dihydro-1,3,2$l^{5}-benzodiazaphosphole-5-carboxylic acid methyl ester Formula: C12H16Cl2N3O3P MolecularWeight: 352.153501

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)NP(=O)(N2)N(CCCl)CCCl

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)NP(=O)(N2)N(CCCl)CCCl

InChI

InChI=1S/C12H16Cl2N3O3P/c1-20-12(18)9-2-3-10-11(8-9)16-21(19,15-10)17(6-4-13)7-5-14/h2-3,8H,4-7H2,1H3,(H2,15,16,19)