N-(2-methyl-3-nitro-phenyl)-2-morpholin-4-yl-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(2-methyl-3-nitro-phenyl)-2-morpholin-4-yl-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(2-methyl-3-nitro-phenyl)-2-morpholino-5-(1-piperidylsulfonyl)benzamide CAS Name: N-(2-methyl-3-nitrophenyl)-2-(4-morpholinyl)-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(2-methyl-3-nitrophenyl)-2-morpholin-4-yl-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(2-methyl-3-nitro-phenyl)-2-morpholino-5-piperidinosulfonyl-benzamide Formula: C23H28N4O6S MolecularWeight: 488.55662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)N4CCOCC4

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)N4CCOCC4

InChI

InChI=1S/C23H28N4O6S/c1-17-20(6-5-7-21(17)27(29)30)24-23(28)19-16-18(34(31,32)26-10-3-2-4-11-26)8-9-22(19)25-12-14-33-15-13-25/h5-9,16H,2-4,10-15H2,1H3,(H,24,28)