aminocarbonyl-(2-chloroethyl)-[2-(4-methoxyphenyl)-1-phosphono-ethyl]-nitroso-azanium

Systemtic Name: aminocarbonyl-(2-chloroethyl)-[2-(4-methoxyphenyl)-1-phosphono-ethyl]-nitroso-azanium Openeye Name: carbamoyl-(2-chloroethyl)-[2-(4-methoxyphenyl)-1-phosphono-ethyl]-nitroso-ammonium CAS Name: carbamoyl-(2-chloroethyl)-[2-(4-methoxyphenyl)-1-phosphonoethyl]-nitrosoammonium IUPAC Name: carbamoyl-(2-chloroethyl)-[2-(4-methoxyphenyl)-1-phosphonoethyl]-nitrosoazanium Traditional Name: carbamoyl-(2-chloroethyl)-[2-(4-methoxyphenyl)-1-phosphono-ethyl]-nitroso-ammonium Formula: C12H18ClN3O6P+ MolecularWeight: 366.714581

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC([N+](CCCl)(C(=O)N)N=O)P(=O)(O)O

Isomeric SMILES

COC1=CC=C(C=C1)CC([N+](CCCl)(C(=O)N)N=O)P(=O)(O)O

InChI

InChI=1S/C12H17ClN3O6P/c1-22-10-4-2-9(3-5-10)8-11(23(19,20)21)16(15-18,7-6-13)12(14)17/h2-5,11H,6-8H2,1H3,(H3-,14,17,19,20,21)/p+1