methyl (1Z,2S,3S)-4-nitro-2,3-diphenyl-N-(2,4,6-trimethylphenyl)sulfonyl-butanimidate

Systemtic Name: methyl (1Z,2S,3S)-4-nitro-2,3-diphenyl-N-(2,4,6-trimethylphenyl)sulfonyl-butanimidate Openeye Name: methyl (1Z,2S,3S)-4-nitro-2,3-diphenyl-N-(2,4,6-trimethylphenyl)sulfonyl-butanimidate CAS Name: (1Z,2S,3S)-4-nitro-2,3-diphenyl-N-(2,4,6-trimethylphenyl)sulfonylbutanimidic acid methyl ester IUPAC Name: methyl (1Z,2S,3S)-4-nitro-2,3-diphenyl-N-(2,4,6-trimethylphenyl)sulfonylbutanimidate Traditional Name: (1Z,2S,3S)-N-mesitylsulfonyl-4-nitro-2,3-diphenyl-butyrimidic acid methyl ester Formula: C26H28N2O5S MolecularWeight: 480.57592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N=C(C(C2=CC=CC=C2)C(C[N+](=O)[O-])C3=CC=CC=C3)OC)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)/N=C(/[C@H](C2=CC=CC=C2)[C@H](C[N+](=O)[O-])C3=CC=CC=C3)\OC)C

InChI

InChI=1S/C26H28N2O5S/c1-18-15-19(2)25(20(3)16-18)34(31,32)27-26(33-4)24(22-13-9-6-10-14-22)23(17-28(29)30)21-11-7-5-8-12-21/h5-16,23-24H,17H2,1-4H3/b27-26-/t23-,24-/m1/s1