N-(2-methoxyphenyl)-2-[(2-methyl-2-morpholin-4-yl-propyl)amino]-5-nitro-benzenesulfonamide

Systemtic Name: N-(2-methoxyphenyl)-2-[(2-methyl-2-morpholin-4-yl-propyl)amino]-5-nitro-benzenesulfonamide Openeye Name: N-(2-methoxyphenyl)-2-[(2-methyl-2-morpholino-propyl)amino]-5-nitro-benzenesulfonamide CAS Name: N-(2-methoxyphenyl)-2-[[2-methyl-2-(4-morpholinyl)propyl]amino]-5-nitrobenzenesulfonamide IUPAC Name: N-(2-methoxyphenyl)-2-[(2-methyl-2-morpholin-4-ylpropyl)amino]-5-nitrobenzenesulfonamide Traditional Name: N-(2-methoxyphenyl)-2-[(2-methyl-2-morpholino-propyl)amino]-5-nitro-benzenesulfonamide Formula: C21H28N4O6S MolecularWeight: 464.53522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=CC=C2OC)N3CCOCC3

Isomeric SMILES

CC(C)(CNC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=CC=C2OC)N3CCOCC3

InChI

InChI=1S/C21H28N4O6S/c1-21(2,24-10-12-31-13-11-24)15-22-18-9-8-16(25(26)27)14-20(18)32(28,29)23-17-6-4-5-7-19(17)30-3/h4-9,14,22-23H,10-13,15H2,1-3H3