N-[(2R)-4-methylsulfonyl-1-[(3-nitrophenyl)amino]-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: N-[(2R)-4-methylsulfonyl-1-[(3-nitrophenyl)amino]-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: N-[(1R)-3-methylsulfonyl-1-[(3-nitrophenyl)carbamoyl]propyl]benzamide CAS Name: N-[(2R)-4-methylsulfonyl-1-(3-nitroanilino)-1-oxobutan-2-yl]benzamide IUPAC Name: N-[(2R)-4-methylsulfonyl-1-(3-nitroanilino)-1-oxobutan-2-yl]benzamide Traditional Name: N-[(1R)-3-mesyl-1-[(3-nitrophenyl)carbamoyl]propyl]benzamide Formula: C18H19N3O6S MolecularWeight: 405.42496

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])NC(=O)C2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)CC[C@H](C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H19N3O6S/c1-28(26,27)11-10-16(20-17(22)13-6-3-2-4-7-13)18(23)19-14-8-5-9-15(12-14)21(24)25/h2-9,12,16H,10-11H2,1H3,(H,19,23)(H,20,22)/t16-/m1/s1