N-methyl-4-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methylamino]-3-nitro-benzenesulfonamide

Systemtic Name: N-methyl-4-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methylamino]-3-nitro-benzenesulfonamide Openeye Name: N-methyl-4-[[2-(morpholinosulfonylmethyl)phenyl]methylamino]-3-nitro-benzenesulfonamide CAS Name: N-methyl-4-[[2-(4-morpholinylsulfonylmethyl)phenyl]methylamino]-3-nitrobenzenesulfonamide IUPAC Name: N-methyl-4-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methylamino]-3-nitrobenzenesulfonamide Traditional Name: N-methyl-4-[[2-(morpholinosulfonylmethyl)benzyl]amino]-3-nitro-benzenesulfonamide Formula: C19H24N4O7S2 MolecularWeight: 484.54646

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)NCC2=CC=CC=C2CS(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)NCC2=CC=CC=C2CS(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H24N4O7S2/c1-20-32(28,29)17-6-7-18(19(12-17)23(24)25)21-13-15-4-2-3-5-16(15)14-31(26,27)22-8-10-30-11-9-22/h2-7,12,20-21H,8-11,13-14H2,1H3