methyl (E)-3-[[bis(2-methoxyethoxy)phosphoryl-phenyl-methyl]amino]-2-cyano-3-methylsulfanyl-prop-2-enoate

Systemtic Name: methyl (E)-3-[[bis(2-methoxyethoxy)phosphoryl-phenyl-methyl]amino]-2-cyano-3-methylsulfanyl-prop-2-enoate Openeye Name: methyl (E)-3-[[bis(2-methoxyethoxy)phosphoryl-phenyl-methyl]amino]-2-cyano-3-methylsulfanyl-prop-2-enoate CAS Name: (E)-3-[[bis(2-methoxyethoxy)phosphoryl-phenylmethyl]amino]-2-cyano-3-(methylthio)-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[[bis(2-methoxyethoxy)phosphoryl-phenylmethyl]amino]-2-cyano-3-methylsulfanylprop-2-enoate Traditional Name: (E)-3-[[bis(2-methoxyethoxy)phosphoryl-phenyl-methyl]amino]-2-cyano-3-(methylthio)acrylic acid methyl ester Formula: C19H27N2O7PS MolecularWeight: 458.465641

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Descriptors Computed from Structure

Canonical SMILES:

COCCOP(=O)(C(C1=CC=CC=C1)NC(=C(C#N)C(=O)OC)SC)OCCOC

Isomeric SMILES

COCCOP(=O)(C(C1=CC=CC=C1)N/C(=C(/C#N)\C(=O)OC)/SC)OCCOC

InChI

InChI=1S/C19H27N2O7PS/c1-24-10-12-27-29(23,28-13-11-25-2)17(15-8-6-5-7-9-15)21-18(30-4)16(14-20)19(22)26-3/h5-9,17,21H,10-13H2,1-4H3/b18-16+