methyl 2-[[5-(4-methylphenyl)-2-phenyl-1,2,3-diazaphosphol-4-yl]sulfonyl]ethanoate

Systemtic Name: methyl 2-[[5-(4-methylphenyl)-2-phenyl-1,2,3-diazaphosphol-4-yl]sulfonyl]ethanoate Openeye Name: methyl 2-[2-phenyl-5-(p-tolyl)diazaphosphol-4-yl]sulfonylacetate CAS Name: 2-[[5-(4-methylphenyl)-2-phenyl-4-diazaphospholyl]sulfonyl]acetic acid methyl ester IUPAC Name: methyl 2-[5-(4-methylphenyl)-2-phenyldiazaphosphol-4-yl]sulfonylacetate Traditional Name: 2-[2-phenyl-5-(p-tolyl)diazaphosphol-4-yl]sulfonylacetic acid methyl ester Formula: C18H17N2O4PS MolecularWeight: 388.377341

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(P=C2S(=O)(=O)CC(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(P=C2S(=O)(=O)CC(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C18H17N2O4PS/c1-13-8-10-14(11-9-13)17-18(26(22,23)12-16(21)24-2)25-20(19-17)15-6-4-3-5-7-15/h3-11H,12H2,1-2H3