N-(4-butan-2-ylphenyl)-2-methoxy-5-nitro-benzenesulfonamide

Systemtic Name: N-(4-butan-2-ylphenyl)-2-methoxy-5-nitro-benzenesulfonamide Openeye Name: 2-methoxy-5-nitro-N-(4-sec-butylphenyl)benzenesulfonamide CAS Name: N-(4-butan-2-ylphenyl)-2-methoxy-5-nitrobenzenesulfonamide IUPAC Name: N-(4-butan-2-ylphenyl)-2-methoxy-5-nitrobenzenesulfonamide Traditional Name: 2-methoxy-5-nitro-N-(4-sec-butylphenyl)benzenesulfonamide Formula: C17H20N2O5S MolecularWeight: 364.4161

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])OC

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C17H20N2O5S/c1-4-12(2)13-5-7-14(8-6-13)18-25(22,23)17-11-15(19(20)21)9-10-16(17)24-3/h5-12,18H,4H2,1-3H3