4-methyl-N-(4-morpholin-4-ylphenyl)-3,5-dinitro-benzamide

Systemtic Name: 4-methyl-N-(4-morpholin-4-ylphenyl)-3,5-dinitro-benzamide Openeye Name: 4-methyl-N-(4-morpholinophenyl)-3,5-dinitro-benzamide CAS Name: 4-methyl-N-[4-(4-morpholinyl)phenyl]-3,5-dinitrobenzamide IUPAC Name: 4-methyl-N-(4-morpholin-4-ylphenyl)-3,5-dinitrobenzamide Traditional Name: 4-methyl-N-(4-morpholinophenyl)-3,5-dinitro-benzamide Formula: C18H18N4O6 MolecularWeight: 386.35872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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