2-methyl-N-(2-morpholin-4-ylcarbonylphenyl)-3,5-dinitro-benzamide

Systemtic Name: 2-methyl-N-(2-morpholin-4-ylcarbonylphenyl)-3,5-dinitro-benzamide Openeye Name: 2-methyl-N-[2-(morpholine-4-carbonyl)phenyl]-3,5-dinitro-benzamide CAS Name: 2-methyl-N-[2-[4-morpholinyl(oxo)methyl]phenyl]-3,5-dinitrobenzamide IUPAC Name: 2-methyl-N-[2-(morpholine-4-carbonyl)phenyl]-3,5-dinitrobenzamide Traditional Name: 2-methyl-N-[2-(morpholine-4-carbonyl)phenyl]-3,5-dinitro-benzamide Formula: C19H18N4O7 MolecularWeight: 414.36882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1C(=O)NC2=CC=CC=C2C(=O)N3CCOCC3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1C(=O)NC2=CC=CC=C2C(=O)N3CCOCC3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O7/c1-12-15(10-13(22(26)27)11-17(12)23(28)29)18(24)20-16-5-3-2-4-14(16)19(25)21-6-8-30-9-7-21/h2-5,10-11H,6-9H2,1H3,(H,20,24)