4-[(3-fluorophenyl)methyl-methyl-amino]-3-nitro-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 4-[(3-fluorophenyl)methyl-methyl-amino]-3-nitro-N-propan-2-yl-benzenesulfonamide Openeye Name: 4-[(3-fluorophenyl)methyl-methyl-amino]-N-isopropyl-3-nitro-benzenesulfonamide CAS Name: 4-[(3-fluorophenyl)methyl-methylamino]-3-nitro-N-propan-2-ylbenzenesulfonamide IUPAC Name: 4-[(3-fluorophenyl)methyl-methylamino]-3-nitro-N-propan-2-ylbenzenesulfonamide Traditional Name: 4-[(3-fluorobenzyl)-methyl-amino]-N-isopropyl-3-nitro-benzenesulfonamide Formula: C17H20FN3O4S MolecularWeight: 381.421803

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)N(C)CC2=CC(=CC=C2)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)N(C)CC2=CC(=CC=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C17H20FN3O4S/c1-12(2)19-26(24,25)15-7-8-16(17(10-15)21(22)23)20(3)11-13-5-4-6-14(18)9-13/h4-10,12,19H,11H2,1-3H3