2-chloranyl-N-[3-(2,5-dimethylpyrazol-3-yl)oxypropyl]-5-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[3-(2,5-dimethylpyrazol-3-yl)oxypropyl]-5-nitro-benzamide Openeye Name: 2-chloro-N-[3-(2,5-dimethylpyrazol-3-yl)oxypropyl]-5-nitro-benzamide CAS Name: 2-chloro-N-[3-[(2,5-dimethyl-3-pyrazolyl)oxy]propyl]-5-nitrobenzamide IUPAC Name: 2-chloro-N-[3-(2,5-dimethylpyrazol-3-yl)oxypropyl]-5-nitrobenzamide Traditional Name: 2-chloro-N-[3-(2,5-dimethylpyrazol-3-yl)oxypropyl]-5-nitro-benzamide Formula: C15H17ClN4O4 MolecularWeight: 352.77288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)OCCCNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C

Isomeric SMILES

CC1=NN(C(=C1)OCCCNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C15H17ClN4O4/c1-10-8-14(19(2)18-10)24-7-3-6-17-15(21)12-9-11(20(22)23)4-5-13(12)16/h4-5,8-9H,3,6-7H2,1-2H3,(H,17,21)