N-[3-chloranyl-4-(2-methylpropoxy)phenyl]-4-(pyrazol-1-ylmethyl)benzamide

Systemtic Name: N-[3-chloranyl-4-(2-methylpropoxy)phenyl]-4-(pyrazol-1-ylmethyl)benzamide Openeye Name: N-(3-chloro-4-isobutoxy-phenyl)-4-(pyrazol-1-ylmethyl)benzamide CAS Name: N-[3-chloro-4-(2-methylpropoxy)phenyl]-4-(1-pyrazolylmethyl)benzamide IUPAC Name: N-[3-chloro-4-(2-methylpropoxy)phenyl]-4-(pyrazol-1-ylmethyl)benzamide Traditional Name: N-(3-chloro-4-isobutoxy-phenyl)-4-(pyrazol-1-ylmethyl)benzamide Formula: C21H22ClN3O2 MolecularWeight: 383.87128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3C=CC=N3)Cl

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3C=CC=N3)Cl

InChI

InChI=1S/C21H22ClN3O2/c1-15(2)14-27-20-9-8-18(12-19(20)22)24-21(26)17-6-4-16(5-7-17)13-25-11-3-10-23-25/h3-12,15H,13-14H2,1-2H3,(H,24,26)