2-methyl-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-3-nitro-benzenesulfonamide

Systemtic Name: 2-methyl-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-3-nitro-benzenesulfonamide Openeye Name: 2-methyl-N-[(4-morpholinosulfonylphenyl)methyl]-3-nitro-benzenesulfonamide CAS Name: 2-methyl-N-[[4-(4-morpholinylsulfonyl)phenyl]methyl]-3-nitrobenzenesulfonamide IUPAC Name: 2-methyl-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-3-nitrobenzenesulfonamide Traditional Name: 2-methyl-N-(4-morpholinosulfonylbenzyl)-3-nitro-benzenesulfonamide Formula: C18H21N3O7S2 MolecularWeight: 455.50524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1S(=O)(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1S(=O)(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O7S2/c1-14-17(21(22)23)3-2-4-18(14)29(24,25)19-13-15-5-7-16(8-6-15)30(26,27)20-9-11-28-12-10-20/h2-8,19H,9-13H2,1H3