N-[4-(2-morpholin-4-ium-4-ylethanoylamino)phenyl]-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-[4-(2-morpholin-4-ium-4-ylethanoylamino)phenyl]-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-[4-[(2-morpholin-4-ium-4-ylacetyl)amino]phenyl]-4-morpholino-3-nitro-benzamide CAS Name: N-[4-[[2-(4-morpholin-4-iumyl)-1-oxoethyl]amino]phenyl]-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-[4-[(2-morpholin-4-ium-4-ylacetyl)amino]phenyl]-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-[4-[(2-morpholin-4-ium-4-ylacetyl)amino]phenyl]-4-morpholino-3-nitro-benzamide Formula: C23H28N5O6+ MolecularWeight: 470.49832

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C23H27N5O6/c29-22(16-26-7-11-33-12-8-26)24-18-2-4-19(5-3-18)25-23(30)17-1-6-20(21(15-17)28(31)32)27-9-13-34-14-10-27/h1-6,15H,7-14,16H2,(H,24,29)(H,25,30)/p+1