N-(2-methyl-4-oxidanyl-5-propan-2-yl-phenyl)-1-(phenoxymethyl)pyrazole-3-carboxamide

Systemtic Name: N-(2-methyl-4-oxidanyl-5-propan-2-yl-phenyl)-1-(phenoxymethyl)pyrazole-3-carboxamide Openeye Name: N-(4-hydroxy-5-isopropyl-2-methyl-phenyl)-1-(phenoxymethyl)pyrazole-3-carboxamide CAS Name: N-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-1-(phenoxymethyl)-3-pyrazolecarboxamide IUPAC Name: N-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-1-(phenoxymethyl)pyrazole-3-carboxamide Traditional Name: N-(4-hydroxy-5-isopropyl-2-methyl-phenyl)-1-(phenoxymethyl)pyrazole-3-carboxamide Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)O)C(C)C)NC(=O)C2=NN(C=C2)COC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C(=C1)O)C(C)C)NC(=O)C2=NN(C=C2)COC3=CC=CC=C3

InChI

InChI=1S/C21H23N3O3/c1-14(2)17-12-19(15(3)11-20(17)25)22-21(26)18-9-10-24(23-18)13-27-16-7-5-4-6-8-16/h4-12,14,25H,13H2,1-3H3,(H,22,26)