N-(4-methylpyridin-2-yl)-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-(4-methylpyridin-2-yl)-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-(4-methyl-2-pyridyl)-4-morpholino-3-nitro-benzamide CAS Name: N-(4-methyl-2-pyridinyl)-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-(4-methylpyridin-2-yl)-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-(4-methyl-2-pyridyl)-4-morpholino-3-nitro-benzamide Formula: C17H18N4O4 MolecularWeight: 342.34922

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N4O4/c1-12-4-5-18-16(10-12)19-17(22)13-2-3-14(15(11-13)21(23)24)20-6-8-25-9-7-20/h2-5,10-11H,6-9H2,1H3,(H,18,19,22)