N-(2-ethylpyrazol-3-yl)-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-(2-ethylpyrazol-3-yl)-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-(2-ethylpyrazol-3-yl)-4-(4-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-(2-ethyl-3-pyrazolyl)-4-(4-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-(2-ethylpyrazol-3-yl)-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-(2-ethylpyrazol-3-yl)-4-(4-methylpiperidino)-3-nitro-benzamide Formula: C18H23N5O3 MolecularWeight: 357.40692

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=N1)NC(=O)C2=CC(=C(C=C2)N3CCC(CC3)C)[N+](=O)[O-]

Isomeric SMILES

CCN1C(=CC=N1)NC(=O)C2=CC(=C(C=C2)N3CCC(CC3)C)[N+](=O)[O-]

InChI

InChI=1S/C18H23N5O3/c1-3-22-17(6-9-19-22)20-18(24)14-4-5-15(16(12-14)23(25)26)21-10-7-13(2)8-11-21/h4-6,9,12-13H,3,7-8,10-11H2,1-2H3,(H,20,24)