[3-(2-methylpropyl)-4-nitro-phenyl]methyl (3R)-1-(4-methylphenyl)sulfonyl-2-oxidanylidene-azetidine-3-carboxylate

Systemtic Name: [3-(2-methylpropyl)-4-nitro-phenyl]methyl (3R)-1-(4-methylphenyl)sulfonyl-2-oxidanylidene-azetidine-3-carboxylate Openeye Name: (3-isobutyl-4-nitro-phenyl)methyl (3R)-2-oxo-1-(p-tolylsulfonyl)azetidine-3-carboxylate CAS Name: (3R)-1-(4-methylphenyl)sulfonyl-2-oxo-3-azetidinecarboxylic acid [3-(2-methylpropyl)-4-nitrophenyl]methyl ester IUPAC Name: [3-(2-methylpropyl)-4-nitrophenyl]methyl (3R)-1-(4-methylphenyl)sulfonyl-2-oxoazetidine-3-carboxylate Traditional Name: (3R)-2-keto-1-tosyl-azetidine-3-carboxylic acid (3-isobutyl-4-nitro-benzyl) ester Formula: C22H24N2O7S MolecularWeight: 460.50016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(C2=O)C(=O)OCC3=CC(=C(C=C3)[N+](=O)[O-])CC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C[C@H](C2=O)C(=O)OCC3=CC(=C(C=C3)[N+](=O)[O-])CC(C)C

InChI

InChI=1S/C22H24N2O7S/c1-14(2)10-17-11-16(6-9-20(17)24(27)28)13-31-22(26)19-12-23(21(19)25)32(29,30)18-7-4-15(3)5-8-18/h4-9,11,14,19H,10,12-13H2,1-3H3/t19-/m1/s1