1-[2-[[(2-chloranyl-4-nitro-phenyl)amino]methyl]phenyl]-N-propan-2-yl-methanesulfonamide

Systemtic Name: 1-[2-[[(2-chloranyl-4-nitro-phenyl)amino]methyl]phenyl]-N-propan-2-yl-methanesulfonamide Openeye Name: 1-[2-[(2-chloro-4-nitro-anilino)methyl]phenyl]-N-isopropyl-methanesulfonamide CAS Name: 1-[2-[(2-chloro-4-nitroanilino)methyl]phenyl]-N-propan-2-ylmethanesulfonamide IUPAC Name: 1-[2-[(2-chloro-4-nitroanilino)methyl]phenyl]-N-propan-2-ylmethanesulfonamide Traditional Name: 1-[2-[(2-chloro-4-nitro-anilino)methyl]phenyl]-N-isopropyl-methanesulfonamide Formula: C17H20ClN3O4S MolecularWeight: 397.8764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)CC1=CC=CC=C1CNC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)NS(=O)(=O)CC1=CC=CC=C1CNC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H20ClN3O4S/c1-12(2)20-26(24,25)11-14-6-4-3-5-13(14)10-19-17-8-7-15(21(22)23)9-16(17)18/h3-9,12,19-20H,10-11H2,1-2H3