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

Systemtic Name: 3-methyl-N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-yl-phenyl)-4-nitro-benzamide Openeye Name: 3-methyl-N-[5-morpholinosulfonyl-2-(1-piperidyl)phenyl]-4-nitro-benzamide CAS Name: 3-methyl-N-[5-(4-morpholinylsulfonyl)-2-(1-piperidinyl)phenyl]-4-nitrobenzamide IUPAC Name: 3-methyl-N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)-4-nitrobenzamide Traditional Name: 3-methyl-N-(5-morpholinosulfonyl-2-piperidino-phenyl)-4-nitro-benzamide Formula: C23H28N4O6S MolecularWeight: 488.55662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCCC4)[N+](=O)[O-]

InChI

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