4-[(2-chloranyl-4-nitro-phenoxy)methyl]-N-[1-(2-ethylpyrazol-3-yl)ethyl]benzamide

Systemtic Name: 4-[(2-chloranyl-4-nitro-phenoxy)methyl]-N-[1-(2-ethylpyrazol-3-yl)ethyl]benzamide Openeye Name: 4-[(2-chloro-4-nitro-phenoxy)methyl]-N-[1-(2-ethylpyrazol-3-yl)ethyl]benzamide CAS Name: 4-[(2-chloro-4-nitrophenoxy)methyl]-N-[1-(2-ethyl-3-pyrazolyl)ethyl]benzamide IUPAC Name: 4-[(2-chloro-4-nitrophenoxy)methyl]-N-[1-(2-ethylpyrazol-3-yl)ethyl]benzamide Traditional Name: 4-[(2-chloro-4-nitro-phenoxy)methyl]-N-[1-(2-ethylpyrazol-3-yl)ethyl]benzamide Formula: C21H21ClN4O4 MolecularWeight: 428.86884

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=N1)C(C)NC(=O)C2=CC=C(C=C2)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CCN1C(=CC=N1)C(C)NC(=O)C2=CC=C(C=C2)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H21ClN4O4/c1-3-25-19(10-11-23-25)14(2)24-21(27)16-6-4-15(5-7-16)13-30-20-9-8-17(26(28)29)12-18(20)22/h4-12,14H,3,13H2,1-2H3,(H,24,27)