4-(2-cyanophenoxy)-N-[(2R)-1-methoxypropan-2-yl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-(2-cyanophenoxy)-N-[(2R)-1-methoxypropan-2-yl]-3-nitro-benzenesulfonamide Openeye Name: 4-(2-cyanophenoxy)-N-[(1R)-2-methoxy-1-methyl-ethyl]-3-nitro-benzenesulfonamide CAS Name: 4-(2-cyanophenoxy)-N-[(2R)-1-methoxypropan-2-yl]-3-nitrobenzenesulfonamide IUPAC Name: 4-(2-cyanophenoxy)-N-[(2R)-1-methoxypropan-2-yl]-3-nitrobenzenesulfonamide Traditional Name: 4-(2-cyanophenoxy)-N-[(1R)-2-methoxy-1-methyl-ethyl]-3-nitro-benzenesulfonamide Formula: C17H17N3O6S MolecularWeight: 391.39838

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NS(=O)(=O)C1=CC(=C(C=C1)OC2=CC=CC=C2C#N)[N+](=O)[O-]

Isomeric SMILES

C[C@H](COC)NS(=O)(=O)C1=CC(=C(C=C1)OC2=CC=CC=C2C#N)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O6S/c1-12(11-25-2)19-27(23,24)14-7-8-17(15(9-14)20(21)22)26-16-6-4-3-5-13(16)10-18/h3-9,12,19H,11H2,1-2H3/t12-/m1/s1