[[(2-ethoxy-2-oxidanylidene-ethyl)-phenylmethoxycarbonyl-amino]-bis(propan-2-ylsulfanyl)methyl]phosphonic acid

Systemtic Name: [[(2-ethoxy-2-oxidanylidene-ethyl)-phenylmethoxycarbonyl-amino]-bis(propan-2-ylsulfanyl)methyl]phosphonic acid Openeye Name: [[benzyloxycarbonyl-(2-ethoxy-2-oxo-ethyl)amino]-bis(isopropylsulfanyl)methyl]phosphonic acid CAS Name: [[(2-ethoxy-2-oxoethyl)-phenylmethoxycarbonylamino]-bis(propan-2-ylthio)methyl]phosphonic acid IUPAC Name: [[(2-ethoxy-2-oxoethyl)-phenylmethoxycarbonylamino]-bis(propan-2-ylsulfanyl)methyl]phosphonic acid Traditional Name: [[carbobenzoxy-(2-ethoxy-2-keto-ethyl)amino]-bis(isopropylthio)methyl]phosphonic acid Formula: C19H30NO7PS2 MolecularWeight: 479.547761

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C(=O)OCC1=CC=CC=C1)C(P(=O)(O)O)(SC(C)C)SC(C)C

Isomeric SMILES

CCOC(=O)CN(C(=O)OCC1=CC=CC=C1)C(P(=O)(O)O)(SC(C)C)SC(C)C

InChI

InChI=1S/C19H30NO7PS2/c1-6-26-17(21)12-20(18(22)27-13-16-10-8-7-9-11-16)19(28(23,24)25,29-14(2)3)30-15(4)5/h7-11,14-15H,6,12-13H2,1-5H3,(H2,23,24,25)