dimethyl (2S)-2-[[2-cyanoethoxy(phenyl)phosphinothioyl]amino]pentanedioate

Systemtic Name: dimethyl (2S)-2-[[2-cyanoethoxy(phenyl)phosphinothioyl]amino]pentanedioate Openeye Name: dimethyl (2S)-2-[[2-cyanoethoxy(phenyl)phosphinothioyl]amino]pentanedioate CAS Name: (2S)-2-[[2-cyanoethoxy(phenyl)phosphinothioyl]amino]pentanedioic acid dimethyl ester IUPAC Name: dimethyl (2S)-2-[[2-cyanoethoxy(phenyl)phosphinothioyl]amino]pentanedioate Traditional Name: (2S)-2-[[2-cyanoethoxy(phenyl)thiophosphoryl]amino]glutaric acid dimethyl ester Formula: C16H21N2O5PS MolecularWeight: 384.387101

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(C(=O)OC)NP(=S)(C1=CC=CC=C1)OCCC#N

Isomeric SMILES

COC(=O)CC[C@@H](C(=O)OC)NP(=S)(C1=CC=CC=C1)OCCC#N

InChI

InChI=1S/C16H21N2O5PS/c1-21-15(19)10-9-14(16(20)22-2)18-24(25,23-12-6-11-17)13-7-4-3-5-8-13/h3-5,7-8,14H,6,9-10,12H2,1-2H3,(H,18,25)/t14-,24?/m0/s1