N-[1-[(3,4-dichlorophenyl)methyl]pyrazol-4-yl]-2-(5-methyl-3-nitro-pyrazol-1-yl)butanamide

Systemtic Name: N-[1-[(3,4-dichlorophenyl)methyl]pyrazol-4-yl]-2-(5-methyl-3-nitro-pyrazol-1-yl)butanamide Openeye Name: N-[1-[(3,4-dichlorophenyl)methyl]pyrazol-4-yl]-2-(5-methyl-3-nitro-pyrazol-1-yl)butanamide CAS Name: N-[1-[(3,4-dichlorophenyl)methyl]-4-pyrazolyl]-2-(5-methyl-3-nitro-1-pyrazolyl)butanamide IUPAC Name: N-[1-[(3,4-dichlorophenyl)methyl]pyrazol-4-yl]-2-(5-methyl-3-nitropyrazol-1-yl)butanamide Traditional Name: N-[1-(3,4-dichlorobenzyl)pyrazol-4-yl]-2-(5-methyl-3-nitro-pyrazol-1-yl)butyramide Formula: C18H18Cl2N6O3 MolecularWeight: 437.27992

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18Cl2N6O3/c1-3-16(25-11(2)6-17(23-25)26(28)29)18(27)22-13-8-21-24(10-13)9-12-4-5-14(19)15(20)7-12/h4-8,10,16H,3,9H2,1-2H3,(H,22,27)