N-(3-chloranyl-2-morpholin-4-yl-phenyl)-4-methoxy-2-nitro-benzenesulfonamide

Systemtic Name: N-(3-chloranyl-2-morpholin-4-yl-phenyl)-4-methoxy-2-nitro-benzenesulfonamide Openeye Name: N-(3-chloro-2-morpholino-phenyl)-4-methoxy-2-nitro-benzenesulfonamide CAS Name: N-[3-chloro-2-(4-morpholinyl)phenyl]-4-methoxy-2-nitrobenzenesulfonamide IUPAC Name: N-(3-chloro-2-morpholin-4-ylphenyl)-4-methoxy-2-nitrobenzenesulfonamide Traditional Name: N-(3-chloro-2-morpholino-phenyl)-4-methoxy-2-nitro-benzenesulfonamide Formula: C17H18ClN3O6S MolecularWeight: 427.85932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)S(=O)(=O)NC2=C(C(=CC=C2)Cl)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)S(=O)(=O)NC2=C(C(=CC=C2)Cl)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H18ClN3O6S/c1-26-12-5-6-16(15(11-12)21(22)23)28(24,25)19-14-4-2-3-13(18)17(14)20-7-9-27-10-8-20/h2-6,11,19H,7-10H2,1H3