N,N-diethyl-4-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)piperazine-1-sulfonamide

Systemtic Name: N,N-diethyl-4-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)piperazine-1-sulfonamide Openeye Name: N,N-diethyl-4-(4-morpholinosulfonyl-2-nitro-phenyl)piperazine-1-sulfonamide CAS Name: N,N-diethyl-4-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]-1-piperazinesulfonamide IUPAC Name: N,N-diethyl-4-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)piperazine-1-sulfonamide Traditional Name: N,N-diethyl-4-(4-morpholinosulfonyl-2-nitro-phenyl)piperazine-1-sulfonamide Formula: C18H29N5O7S2 MolecularWeight: 491.58216

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)N1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)N1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H29N5O7S2/c1-3-20(4-2)32(28,29)22-9-7-19(8-10-22)17-6-5-16(15-18(17)23(24)25)31(26,27)21-11-13-30-14-12-21/h5-6,15H,3-4,7-14H2,1-2H3