2-[bis(2-methoxyphenoxy)phosphorylmethylamino]ethanenitrile; methanesulfonic acid

Systemtic Name: 2-[bis(2-methoxyphenoxy)phosphorylmethylamino]ethanenitrile; methanesulfonic acid Openeye Name: 2-[bis(2-methoxyphenoxy)phosphorylmethylamino]acetonitrile; methanesulfonic acid CAS Name: 2-[bis(2-methoxyphenoxy)phosphorylmethylamino]acetonitrile; methanesulfonic acid IUPAC Name: 2-[bis(2-methoxyphenoxy)phosphorylmethylamino]acetonitrile; methanesulfonic acid Traditional Name: 2-[bis(2-methoxyphenoxy)phosphorylmethylamino]acetonitrile; mesylic acid Formula: C18H23N2O8PS MolecularWeight: 458.422581

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OP(=O)(CNCC#N)OC2=CC=CC=C2OC.CS(=O)(=O)O

Isomeric SMILES

COC1=CC=CC=C1OP(=O)(CNCC#N)OC2=CC=CC=C2OC.CS(=O)(=O)O

InChI

InChI=1S/C17H19N2O5P.CH4O3S/c1-21-14-7-3-5-9-16(14)23-25(20,13-19-12-11-18)24-17-10-6-4-8-15(17)22-2;1-5(2,3)4/h3-10,19H,12-13H2,1-2H3;1H3,(H,2,3,4)