N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-4-morpholino-3-nitro-benzamide CAS Name: N-methyl-N-[(1-methyl-4-pyrazolyl)methyl]-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-4-morpholino-3-nitro-benzamide Formula: C17H21N5O4 MolecularWeight: 359.37974

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CN(C)C(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=N1)CN(C)C(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N5O4/c1-19(11-13-10-18-20(2)12-13)17(23)14-3-4-15(16(9-14)22(24)25)21-5-7-26-8-6-21/h3-4,9-10,12H,5-8,11H2,1-2H3