2-(4-chloranyl-5-methyl-3-nitro-pyrazol-1-yl)-N-[4-(pyridin-4-ylmethyl)phenyl]ethanamide

Systemtic Name: 2-(4-chloranyl-5-methyl-3-nitro-pyrazol-1-yl)-N-[4-(pyridin-4-ylmethyl)phenyl]ethanamide Openeye Name: 2-(4-chloro-5-methyl-3-nitro-pyrazol-1-yl)-N-[4-(4-pyridylmethyl)phenyl]acetamide CAS Name: 2-(4-chloro-5-methyl-3-nitro-1-pyrazolyl)-N-[4-(pyridin-4-ylmethyl)phenyl]acetamide IUPAC Name: 2-(4-chloro-5-methyl-3-nitropyrazol-1-yl)-N-[4-(pyridin-4-ylmethyl)phenyl]acetamide Traditional Name: 2-(4-chloro-5-methyl-3-nitro-pyrazol-1-yl)-N-[4-(4-pyridylmethyl)phenyl]acetamide Formula: C18H16ClN5O3 MolecularWeight: 385.80434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=CC=C(C=C2)CC3=CC=NC=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=CC=C(C=C2)CC3=CC=NC=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H16ClN5O3/c1-12-17(19)18(24(26)27)22-23(12)11-16(25)21-15-4-2-13(3-5-15)10-14-6-8-20-9-7-14/h2-9H,10-11H2,1H3,(H,21,25)