N-(4-methoxy-2-nitro-phenyl)-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-(4-methoxy-2-nitro-phenyl)-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-(4-methoxy-2-nitro-phenyl)-4-morpholino-3-nitro-benzamide CAS Name: N-(4-methoxy-2-nitrophenyl)-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-(4-methoxy-2-nitrophenyl)-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-(4-methoxy-2-nitro-phenyl)-4-morpholino-3-nitro-benzamide Formula: C18H18N4O7 MolecularWeight: 402.35812

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O7/c1-28-13-3-4-14(16(11-13)21(24)25)19-18(23)12-2-5-15(17(10-12)22(26)27)20-6-8-29-9-7-20/h2-5,10-11H,6-9H2,1H3,(H,19,23)