methyl 2-[[chloranyl-(4-nitrophenoxy)phosphinothioyl]amino]-3-methyl-butanoate

Systemtic Name: methyl 2-[[chloranyl-(4-nitrophenoxy)phosphinothioyl]amino]-3-methyl-butanoate Openeye Name: methyl 2-[[chloro-(4-nitrophenoxy)phosphinothioyl]amino]-3-methyl-butanoate CAS Name: 2-[[chloro-(4-nitrophenoxy)phosphinothioyl]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-[[chloro-(4-nitrophenoxy)phosphinothioyl]amino]-3-methylbutanoate Traditional Name: 2-[[chloro-(4-nitrophenoxy)thiophosphoryl]amino]-3-methyl-butyric acid methyl ester Formula: C12H16ClN2O5PS MolecularWeight: 366.757601

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NP(=S)(OC1=CC=C(C=C1)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)C(C(=O)OC)NP(=S)(OC1=CC=C(C=C1)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H16ClN2O5PS/c1-8(2)11(12(16)19-3)14-21(13,22)20-10-6-4-9(5-7-10)15(17)18/h4-8,11H,1-3H3,(H,14,22)