N-[4-[(2S)-butan-2-yl]phenyl]-4-methoxy-3-nitro-benzenesulfonamide

Systemtic Name: N-[4-[(2S)-butan-2-yl]phenyl]-4-methoxy-3-nitro-benzenesulfonamide Openeye Name: 4-methoxy-N-[4-[(1S)-1-methylpropyl]phenyl]-3-nitro-benzenesulfonamide CAS Name: N-[4-[(2S)-butan-2-yl]phenyl]-4-methoxy-3-nitrobenzenesulfonamide IUPAC Name: N-[4-[(2S)-butan-2-yl]phenyl]-4-methoxy-3-nitrobenzenesulfonamide Traditional Name: 4-methoxy-N-[4-[(1S)-1-methylpropyl]phenyl]-3-nitro-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=CC(=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O5S/c1-4-12(2)13-5-7-14(8-6-13)18-25(22,23)15-9-10-17(24-3)16(11-15)19(20)21/h5-12,18H,4H2,1-3H3/t12-/m0/s1