3-(4-chloranyl-3-methyl-pyrazol-1-yl)-N-[3-(3-methylphenoxy)-5-nitro-phenyl]propanamide

Systemtic Name: 3-(4-chloranyl-3-methyl-pyrazol-1-yl)-N-[3-(3-methylphenoxy)-5-nitro-phenyl]propanamide Openeye Name: 3-(4-chloro-3-methyl-pyrazol-1-yl)-N-[3-(3-methylphenoxy)-5-nitro-phenyl]propanamide CAS Name: 3-(4-chloro-3-methyl-1-pyrazolyl)-N-[3-(3-methylphenoxy)-5-nitrophenyl]propanamide IUPAC Name: 3-(4-chloro-3-methylpyrazol-1-yl)-N-[3-(3-methylphenoxy)-5-nitrophenyl]propanamide Traditional Name: 3-(4-chloro-3-methyl-pyrazol-1-yl)-N-[3-(3-methylphenoxy)-5-nitro-phenyl]propionamide Formula: C20H19ClN4O4 MolecularWeight: 414.84226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CCN3C=C(C(=N3)C)Cl

Isomeric SMILES

CC1=CC(=CC=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CCN3C=C(C(=N3)C)Cl

InChI

InChI=1S/C20H19ClN4O4/c1-13-4-3-5-17(8-13)29-18-10-15(9-16(11-18)25(27)28)22-20(26)6-7-24-12-19(21)14(2)23-24/h3-5,8-12H,6-7H2,1-2H3,(H,22,26)