N-methyl-4-[(1-morpholin-4-ylcyclohexyl)methylamino]-3-nitro-benzenesulfonamide

Systemtic Name: N-methyl-4-[(1-morpholin-4-ylcyclohexyl)methylamino]-3-nitro-benzenesulfonamide Openeye Name: N-methyl-4-[(1-morpholinocyclohexyl)methylamino]-3-nitro-benzenesulfonamide CAS Name: N-methyl-4-[[1-(4-morpholinyl)cyclohexyl]methylamino]-3-nitrobenzenesulfonamide IUPAC Name: N-methyl-4-[(1-morpholin-4-ylcyclohexyl)methylamino]-3-nitrobenzenesulfonamide Traditional Name: N-methyl-4-[(1-morpholinocyclohexyl)methylamino]-3-nitro-benzenesulfonamide Formula: C18H28N4O5S MolecularWeight: 412.50372

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)NCC2(CCCCC2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)NCC2(CCCCC2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H28N4O5S/c1-19-28(25,26)15-5-6-16(17(13-15)22(23)24)20-14-18(7-3-2-4-8-18)21-9-11-27-12-10-21/h5-6,13,19-20H,2-4,7-12,14H2,1H3