N-[(2-chlorophenyl)methyl]-2-(4-nitropyrazol-1-yl)propanamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-2-(4-nitropyrazol-1-yl)propanamide Openeye Name: N-[(2-chlorophenyl)methyl]-2-(4-nitropyrazol-1-yl)propanamide CAS Name: N-[(2-chlorophenyl)methyl]-2-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[(2-chlorophenyl)methyl]-2-(4-nitropyrazol-1-yl)propanamide Traditional Name: N-(2-chlorobenzyl)-2-(4-nitropyrazol-1-yl)propionamide Formula: C13H13ClN4O3 MolecularWeight: 308.72032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1Cl)N2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1Cl)N2C=C(C=N2)[N+](=O)[O-]

InChI

InChI=1S/C13H13ClN4O3/c1-9(17-8-11(7-16-17)18(20)21)13(19)15-6-10-4-2-3-5-12(10)14/h2-5,7-9H,6H2,1H3,(H,15,19)