4-(4-imidazol-1-ylphenoxy)-N-[(2S)-1-methoxypropan-2-yl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-(4-imidazol-1-ylphenoxy)-N-[(2S)-1-methoxypropan-2-yl]-3-nitro-benzenesulfonamide Openeye Name: 4-(4-imidazol-1-ylphenoxy)-N-[(1S)-2-methoxy-1-methyl-ethyl]-3-nitro-benzenesulfonamide CAS Name: 4-[4-(1-imidazolyl)phenoxy]-N-[(2S)-1-methoxypropan-2-yl]-3-nitrobenzenesulfonamide IUPAC Name: 4-(4-imidazol-1-ylphenoxy)-N-[(2S)-1-methoxypropan-2-yl]-3-nitrobenzenesulfonamide Traditional Name: 4-(4-imidazol-1-ylphenoxy)-N-[(1S)-2-methoxy-1-methyl-ethyl]-3-nitro-benzenesulfonamide Formula: C19H20N4O6S MolecularWeight: 432.4503

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NS(=O)(=O)C1=CC(=C(C=C1)OC2=CC=C(C=C2)N3C=CN=C3)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](COC)NS(=O)(=O)C1=CC(=C(C=C1)OC2=CC=C(C=C2)N3C=CN=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O6S/c1-14(12-28-2)21-30(26,27)17-7-8-19(18(11-17)23(24)25)29-16-5-3-15(4-6-16)22-10-9-20-13-22/h3-11,13-14,21H,12H2,1-2H3/t14-/m0/s1