2-chloranyl-N-(4-morpholin-4-yl-3-nitro-phenyl)-5-nitro-benzamide

Systemtic Name: 2-chloranyl-N-(4-morpholin-4-yl-3-nitro-phenyl)-5-nitro-benzamide Openeye Name: 2-chloro-N-(4-morpholino-3-nitro-phenyl)-5-nitro-benzamide CAS Name: 2-chloro-N-[4-(4-morpholinyl)-3-nitrophenyl]-5-nitrobenzamide IUPAC Name: 2-chloro-N-(4-morpholin-4-yl-3-nitrophenyl)-5-nitrobenzamide Traditional Name: 2-chloro-N-(4-morpholino-3-nitro-phenyl)-5-nitro-benzamide Formula: C17H15ClN4O6 MolecularWeight: 406.7772

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H15ClN4O6/c18-14-3-2-12(21(24)25)10-13(14)17(23)19-11-1-4-15(16(9-11)22(26)27)20-5-7-28-8-6-20/h1-4,9-10H,5-8H2,(H,19,23)