2-(4-chloranylpyrazol-1-yl)-N-[3-(2-methylphenoxy)-5-nitro-phenyl]propanamide

Systemtic Name: 2-(4-chloranylpyrazol-1-yl)-N-[3-(2-methylphenoxy)-5-nitro-phenyl]propanamide Openeye Name: 2-(4-chloropyrazol-1-yl)-N-[3-(2-methylphenoxy)-5-nitro-phenyl]propanamide CAS Name: 2-(4-chloro-1-pyrazolyl)-N-[3-(2-methylphenoxy)-5-nitrophenyl]propanamide IUPAC Name: 2-(4-chloropyrazol-1-yl)-N-[3-(2-methylphenoxy)-5-nitrophenyl]propanamide Traditional Name: 2-(4-chloropyrazol-1-yl)-N-[3-(2-methylphenoxy)-5-nitro-phenyl]propionamide Formula: C19H17ClN4O4 MolecularWeight: 400.81568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C(C)N3C=C(C=N3)Cl

Isomeric SMILES

CC1=CC=CC=C1OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C(C)N3C=C(C=N3)Cl

InChI

InChI=1S/C19H17ClN4O4/c1-12-5-3-4-6-18(12)28-17-8-15(7-16(9-17)24(26)27)22-19(25)13(2)23-11-14(20)10-21-23/h3-11,13H,1-2H3,(H,22,25)