N-[(6-morpholin-4-ylpyridin-3-yl)methyl]-4-nitro-benzamide

Systemtic Name: N-[(6-morpholin-4-ylpyridin-3-yl)methyl]-4-nitro-benzamide Openeye Name: N-[(6-morpholino-3-pyridyl)methyl]-4-nitro-benzamide CAS Name: N-[[6-(4-morpholinyl)-3-pyridinyl]methyl]-4-nitrobenzamide IUPAC Name: N-[(6-morpholin-4-ylpyridin-3-yl)methyl]-4-nitrobenzamide Traditional Name: N-[(6-morpholino-3-pyridyl)methyl]-4-nitro-benzamide Formula: C17H18N4O4 MolecularWeight: 342.34922

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N4O4/c22-17(14-2-4-15(5-3-14)21(23)24)19-12-13-1-6-16(18-11-13)20-7-9-25-10-8-20/h1-6,11H,7-10,12H2,(H,19,22)