N-[2,6-bis(chloranyl)-3-methyl-phenyl]-4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)butanamide

Systemtic Name: N-[2,6-bis(chloranyl)-3-methyl-phenyl]-4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)butanamide Openeye Name: N-(2,6-dichloro-3-methyl-phenyl)-4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)butanamide CAS Name: N-(2,6-dichloro-3-methylphenyl)-4-(3,5-dimethyl-4-nitro-1-pyrazolyl)butanamide IUPAC Name: N-(2,6-dichloro-3-methylphenyl)-4-(3,5-dimethyl-4-nitropyrazol-1-yl)butanamide Traditional Name: N-(2,6-dichloro-3-methyl-phenyl)-4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)butyramide Formula: C16H18Cl2N4O3 MolecularWeight: 385.24512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)Cl)NC(=O)CCCN2C(=C(C(=N2)C)[N+](=O)[O-])C)Cl

Isomeric SMILES

CC1=C(C(=C(C=C1)Cl)NC(=O)CCCN2C(=C(C(=N2)C)[N+](=O)[O-])C)Cl

InChI

InChI=1S/C16H18Cl2N4O3/c1-9-6-7-12(17)15(14(9)18)19-13(23)5-4-8-21-11(3)16(22(24)25)10(2)20-21/h6-7H,4-5,8H2,1-3H3,(H,19,23)