4-fluoranyl-N-[(S)-(4-methylphenyl)-phenyl-methyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-[(S)-(4-methylphenyl)-phenyl-methyl]-3-nitro-benzenesulfonamide Openeye Name: 4-fluoro-3-nitro-N-[(S)-phenyl(p-tolyl)methyl]benzenesulfonamide CAS Name: 4-fluoro-N-[(S)-(4-methylphenyl)-phenylmethyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-fluoro-N-[(S)-(4-methylphenyl)-phenylmethyl]-3-nitrobenzenesulfonamide Traditional Name: 4-fluoro-3-nitro-N-[(S)-phenyl(p-tolyl)methyl]benzenesulfonamide Formula: C20H17FN2O4S MolecularWeight: 400.423383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CC=C2)NS(=O)(=O)C3=CC(=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C2=CC=CC=C2)NS(=O)(=O)C3=CC(=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C20H17FN2O4S/c1-14-7-9-16(10-8-14)20(15-5-3-2-4-6-15)22-28(26,27)17-11-12-18(21)19(13-17)23(24)25/h2-13,20,22H,1H3/t20-/m0/s1