N-[1-[(3,4-dichlorophenyl)methyl]pyrazol-4-yl]-2-(4-nitropyrazol-1-yl)propanamide

Systemtic Name: N-[1-[(3,4-dichlorophenyl)methyl]pyrazol-4-yl]-2-(4-nitropyrazol-1-yl)propanamide Openeye Name: N-[1-[(3,4-dichlorophenyl)methyl]pyrazol-4-yl]-2-(4-nitropyrazol-1-yl)propanamide CAS Name: N-[1-[(3,4-dichlorophenyl)methyl]-4-pyrazolyl]-2-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[1-[(3,4-dichlorophenyl)methyl]pyrazol-4-yl]-2-(4-nitropyrazol-1-yl)propanamide Traditional Name: N-[1-(3,4-dichlorobenzyl)pyrazol-4-yl]-2-(4-nitropyrazol-1-yl)propionamide Formula: C16H14Cl2N6O3 MolecularWeight: 409.22676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CN(N=C1)CC2=CC(=C(C=C2)Cl)Cl)N3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1=CN(N=C1)CC2=CC(=C(C=C2)Cl)Cl)N3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C16H14Cl2N6O3/c1-10(23-9-13(6-20-23)24(26)27)16(25)21-12-5-19-22(8-12)7-11-2-3-14(17)15(18)4-11/h2-6,8-10H,7H2,1H3,(H,21,25)