N-[1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-[1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-[1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-[1-[(2-chlorophenyl)methyl]-3-pyrazolyl]-3-(3,5-dimethyl-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-3-(3,5-dimethyl-4-nitropyrazol-1-yl)propanamide Traditional Name: N-[1-(2-chlorobenzyl)pyrazol-3-yl]-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propionamide Formula: C18H19ClN6O3 MolecularWeight: 402.83486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC(=O)NC2=NN(C=C2)CC3=CC=CC=C3Cl)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CCC(=O)NC2=NN(C=C2)CC3=CC=CC=C3Cl)C)[N+](=O)[O-]

InChI

InChI=1S/C18H19ClN6O3/c1-12-18(25(27)28)13(2)24(21-12)10-8-17(26)20-16-7-9-23(22-16)11-14-5-3-4-6-15(14)19/h3-7,9H,8,10-11H2,1-2H3,(H,20,22,26)