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

Systemtic Name: N-(1-methyl-5-morpholin-4-ylcarbonyl-pyrazol-4-yl)-4-nitro-benzamide Openeye Name: N-[1-methyl-5-(morpholine-4-carbonyl)pyrazol-4-yl]-4-nitro-benzamide CAS Name: N-[1-methyl-5-[4-morpholinyl(oxo)methyl]-4-pyrazolyl]-4-nitrobenzamide IUPAC Name: N-[1-methyl-5-(morpholine-4-carbonyl)pyrazol-4-yl]-4-nitrobenzamide Traditional Name: N-[1-methyl-5-(morpholine-4-carbonyl)pyrazol-4-yl]-4-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=C(C=C2)[N+](=O)[O-])C(=O)N3CCOCC3

Isomeric SMILES

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

InChI

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