N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]-4-nitro-benzenesulfonamide Openeye Name: N-[(4-isopropoxy-3-methoxy-phenyl)methyl]-4-nitro-benzenesulfonamide CAS Name: N-[(3-methoxy-4-propan-2-yloxyphenyl)methyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[(3-methoxy-4-propan-2-yloxyphenyl)methyl]-4-nitrobenzenesulfonamide Traditional Name: N-(4-isopropoxy-3-methoxy-benzyl)-4-nitro-benzenesulfonamide Formula: C17H20N2O6S MolecularWeight: 380.4155

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)CNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)CNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C17H20N2O6S/c1-12(2)25-16-9-4-13(10-17(16)24-3)11-18-26(22,23)15-7-5-14(6-8-15)19(20)21/h4-10,12,18H,11H2,1-3H3