N-(3-chloranyl-4-morpholin-4-yl-phenyl)-3,5-dinitro-benzamide

Systemtic Name: N-(3-chloranyl-4-morpholin-4-yl-phenyl)-3,5-dinitro-benzamide Openeye Name: N-(3-chloro-4-morpholino-phenyl)-3,5-dinitro-benzamide CAS Name: N-[3-chloro-4-(4-morpholinyl)phenyl]-3,5-dinitrobenzamide IUPAC Name: N-(3-chloro-4-morpholin-4-ylphenyl)-3,5-dinitrobenzamide Traditional Name: N-(3-chloro-4-morpholino-phenyl)-3,5-dinitro-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=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])Cl

Isomeric SMILES

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

InChI

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