N-(1-methyl-5-morpholin-4-ylcarbonyl-pyrazol-4-yl)-3-nitro-benzamide

Systemtic Name: N-(1-methyl-5-morpholin-4-ylcarbonyl-pyrazol-4-yl)-3-nitro-benzamide Openeye Name: N-[1-methyl-5-(morpholine-4-carbonyl)pyrazol-4-yl]-3-nitro-benzamide CAS Name: N-[1-methyl-5-[4-morpholinyl(oxo)methyl]-4-pyrazolyl]-3-nitrobenzamide IUPAC Name: N-[1-methyl-5-(morpholine-4-carbonyl)pyrazol-4-yl]-3-nitrobenzamide Traditional Name: N-[1-methyl-5-(morpholine-4-carbonyl)pyrazol-4-yl]-3-nitro-benzamide Formula: C16H17N5O5 MolecularWeight: 359.33668

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N5O5/c1-19-14(16(23)20-5-7-26-8-6-20)13(10-17-19)18-15(22)11-3-2-4-12(9-11)21(24)25/h2-4,9-10H,5-8H2,1H3,(H,18,22)