2-[bis(prop-2-enylsulfanyl)phosphorylmethyl-phenylmethoxycarbonyl-amino]-3-ethoxy-butanoic acid

Systemtic Name: 2-[bis(prop-2-enylsulfanyl)phosphorylmethyl-phenylmethoxycarbonyl-amino]-3-ethoxy-butanoic acid Openeye Name: 2-[benzyloxycarbonyl-[bis(allylsulfanyl)phosphorylmethyl]amino]-3-ethoxy-butanoic acid CAS Name: 2-[bis(prop-2-enylthio)phosphorylmethyl-phenylmethoxycarbonylamino]-3-ethoxybutanoic acid IUPAC Name: 2-[bis(prop-2-enylsulfanyl)phosphorylmethyl-phenylmethoxycarbonylamino]-3-ethoxybutanoic acid Traditional Name: 2-[bis(allylthio)phosphorylmethyl-carbobenzoxy-amino]-3-ethoxy-butyric acid Formula: C21H30NO6PS2 MolecularWeight: 487.569761

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C)C(C(=O)O)N(CP(=O)(SCC=C)SCC=C)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCOC(C)C(C(=O)O)N(CP(=O)(SCC=C)SCC=C)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C21H30NO6PS2/c1-5-13-30-29(26,31-14-6-2)16-22(19(20(23)24)17(4)27-7-3)21(25)28-15-18-11-9-8-10-12-18/h5-6,8-12,17,19H,1-2,7,13-16H2,3-4H3,(H,23,24)