N,2,3-trimethyl-N-[(2-morpholin-4-ylphenyl)methyl]-5-nitro-benzenesulfonamide

Systemtic Name: N,2,3-trimethyl-N-[(2-morpholin-4-ylphenyl)methyl]-5-nitro-benzenesulfonamide Openeye Name: N,2,3-trimethyl-N-[(2-morpholinophenyl)methyl]-5-nitro-benzenesulfonamide CAS Name: N,2,3-trimethyl-N-[[2-(4-morpholinyl)phenyl]methyl]-5-nitrobenzenesulfonamide IUPAC Name: N,2,3-trimethyl-N-[(2-morpholin-4-ylphenyl)methyl]-5-nitrobenzenesulfonamide Traditional Name: N,2,3-trimethyl-N-(2-morpholinobenzyl)-5-nitro-benzenesulfonamide Formula: C20H25N3O5S MolecularWeight: 419.4946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)N(C)CC2=CC=CC=C2N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)N(C)CC2=CC=CC=C2N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H25N3O5S/c1-15-12-18(23(24)25)13-20(16(15)2)29(26,27)21(3)14-17-6-4-5-7-19(17)22-8-10-28-11-9-22/h4-7,12-13H,8-11,14H2,1-3H3