N-[3-[(2-chloranyl-4-nitro-phenyl)amino]propyl]-1-phenyl-methanesulfonamide

Systemtic Name: N-[3-[(2-chloranyl-4-nitro-phenyl)amino]propyl]-1-phenyl-methanesulfonamide Openeye Name: N-[3-(2-chloro-4-nitro-anilino)propyl]-1-phenyl-methanesulfonamide CAS Name: N-[3-(2-chloro-4-nitroanilino)propyl]-1-phenylmethanesulfonamide IUPAC Name: N-[3-(2-chloro-4-nitroanilino)propyl]-1-phenylmethanesulfonamide Traditional Name: N-[3-(2-chloro-4-nitro-anilino)propyl]-1-phenyl-methanesulfonamide Formula: C16H18ClN3O4S MolecularWeight: 383.84982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)NCCCNC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)NCCCNC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H18ClN3O4S/c17-15-11-14(20(21)22)7-8-16(15)18-9-4-10-19-25(23,24)12-13-5-2-1-3-6-13/h1-3,5-8,11,18-19H,4,9-10,12H2