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

Systemtic Name: methyl (1Z,2S,3S)-4-nitro-2,3-diphenyl-N-(phenylsulfonyl)butanimidate Openeye Name: methyl (1Z,2S,3S)-N-(benzenesulfonyl)-4-nitro-2,3-diphenyl-butanimidate CAS Name: (1Z,2S,3S)-N-(benzenesulfonyl)-4-nitro-2,3-diphenylbutanimidic acid methyl ester IUPAC Name: methyl (1Z,2S,3S)-N-(benzenesulfonyl)-4-nitro-2,3-diphenylbutanimidate Traditional Name: (1Z,2S,3S)-N-besyl-4-nitro-2,3-diphenyl-butyrimidic acid methyl ester Formula: C23H22N2O5S MolecularWeight: 438.49618

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Descriptors Computed from Structure

Canonical SMILES:

COC(=NS(=O)(=O)C1=CC=CC=C1)C(C2=CC=CC=C2)C(C[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CO/C(=N\S(=O)(=O)C1=CC=CC=C1)/[C@H](C2=CC=CC=C2)[C@H](C[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C23H22N2O5S/c1-30-23(24-31(28,29)20-15-9-4-10-16-20)22(19-13-7-3-8-14-19)21(17-25(26)27)18-11-5-2-6-12-18/h2-16,21-22H,17H2,1H3/b24-23-/t21-,22-/m1/s1