methyl (1Z,2S,3S)-N-methylsulfonyl-4-nitro-2,3-diphenyl-butanimidate

Systemtic Name: methyl (1Z,2S,3S)-N-methylsulfonyl-4-nitro-2,3-diphenyl-butanimidate Openeye Name: methyl (1Z,2S,3S)-N-methylsulfonyl-4-nitro-2,3-diphenyl-butanimidate CAS Name: (1Z,2S,3S)-N-methylsulfonyl-4-nitro-2,3-diphenylbutanimidic acid methyl ester IUPAC Name: methyl (1Z,2S,3S)-N-methylsulfonyl-4-nitro-2,3-diphenylbutanimidate Traditional Name: (1Z,2S,3S)-N-mesyl-4-nitro-2,3-diphenyl-butyrimidic acid methyl ester Formula: C18H20N2O5S MolecularWeight: 376.4268

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Descriptors Computed from Structure

Canonical SMILES:

COC(=NS(=O)(=O)C)C(C1=CC=CC=C1)C(C[N+](=O)[O-])C2=CC=CC=C2

Isomeric SMILES

CO/C(=N\S(=O)(=O)C)/[C@H](C1=CC=CC=C1)[C@H](C[N+](=O)[O-])C2=CC=CC=C2

InChI

InChI=1S/C18H20N2O5S/c1-25-18(19-26(2,23)24)17(15-11-7-4-8-12-15)16(13-20(21)22)14-9-5-3-6-10-14/h3-12,16-17H,13H2,1-2H3/b19-18-/t16-,17-/m1/s1