3-methyl-N-(4-morpholin-4-yl-3-nitro-phenyl)-4-nitro-benzamide

Systemtic Name: 3-methyl-N-(4-morpholin-4-yl-3-nitro-phenyl)-4-nitro-benzamide Openeye Name: 3-methyl-N-(4-morpholino-3-nitro-phenyl)-4-nitro-benzamide CAS Name: 3-methyl-N-[4-(4-morpholinyl)-3-nitrophenyl]-4-nitrobenzamide IUPAC Name: 3-methyl-N-(4-morpholin-4-yl-3-nitrophenyl)-4-nitrobenzamide Traditional Name: 3-methyl-N-(4-morpholino-3-nitro-phenyl)-4-nitro-benzamide Formula: C18H18N4O6 MolecularWeight: 386.35872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O6/c1-12-10-13(2-4-15(12)21(24)25)18(23)19-14-3-5-16(17(11-14)22(26)27)20-6-8-28-9-7-20/h2-5,10-11H,6-9H2,1H3,(H,19,23)