N-[(1R,3S,4R)-3-bicyclo[2.2.1]heptanyl]-2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-[(1R,3S,4R)-3-bicyclo[2.2.1]heptanyl]-2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]ethanamide Openeye Name: 2-(2-methoxy-N-methylsulfonyl-5-nitro-anilino)-N-[(1R,2S,4R)-norbornan-2-yl]acetamide CAS Name: N-[(1R,3S,4R)-3-bicyclo[2.2.1]heptanyl]-2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)acetamide IUPAC Name: N-[(1R,3S,4R)-3-bicyclo[2.2.1]heptanyl]-2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)acetamide Traditional Name: 2-(N-mesyl-2-methoxy-5-nitro-anilino)-N-[(1R,2S,4R)-norbornan-2-yl]acetamide Formula: C17H23N3O6S MolecularWeight: 397.44602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NC2CC3CCC2C3)S(=O)(=O)C

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)N[C@H]2C[C@@H]3CC[C@@H]2C3)S(=O)(=O)C

InChI

InChI=1S/C17H23N3O6S/c1-26-16-6-5-13(20(22)23)9-15(16)19(27(2,24)25)10-17(21)18-14-8-11-3-4-12(14)7-11/h5-6,9,11-12,14H,3-4,7-8,10H2,1-2H3,(H,18,21)/t11-,12-,14+/m1/s1