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

Systemtic Name: N,N-diethyl-4-[(1-morpholin-4-ylcyclohexyl)methylamino]-3-nitro-benzenesulfonamide Openeye Name: N,N-diethyl-4-[(1-morpholinocyclohexyl)methylamino]-3-nitro-benzenesulfonamide CAS Name: N,N-diethyl-4-[[1-(4-morpholinyl)cyclohexyl]methylamino]-3-nitrobenzenesulfonamide IUPAC Name: N,N-diethyl-4-[(1-morpholin-4-ylcyclohexyl)methylamino]-3-nitrobenzenesulfonamide Traditional Name: N,N-diethyl-4-[(1-morpholinocyclohexyl)methylamino]-3-nitro-benzenesulfonamide Formula: C21H34N4O5S MolecularWeight: 454.58346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H34N4O5S/c1-3-24(4-2)31(28,29)18-8-9-19(20(16-18)25(26)27)22-17-21(10-6-5-7-11-21)23-12-14-30-15-13-23/h8-9,16,22H,3-7,10-15,17H2,1-2H3