N-[3-methoxy-4-(pentanoylamino)phenyl]-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-[3-methoxy-4-(pentanoylamino)phenyl]-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-[3-methoxy-4-(pentanoylamino)phenyl]-4-morpholino-3-nitro-benzamide CAS Name: N-[3-methoxy-4-(1-oxopentylamino)phenyl]-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-[3-methoxy-4-(pentanoylamino)phenyl]-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-[3-methoxy-4-(valerylamino)phenyl]-4-morpholino-3-nitro-benzamide Formula: C23H28N4O6 MolecularWeight: 456.49162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-])OC

Isomeric SMILES

CCCCC(=O)NC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-])OC

InChI

InChI=1S/C23H28N4O6/c1-3-4-5-22(28)25-18-8-7-17(15-21(18)32-2)24-23(29)16-6-9-19(20(14-16)27(30)31)26-10-12-33-13-11-26/h6-9,14-15H,3-5,10-13H2,1-2H3,(H,24,29)(H,25,28)