[4-[2-(4-methoxyphenyl)-5-(2-methylpropanoyl)pyrazol-3-yl]phenyl]methylcarbamic acid

Systemtic Name: [4-[2-(4-methoxyphenyl)-5-(2-methylpropanoyl)pyrazol-3-yl]phenyl]methylcarbamic acid Openeye Name: [4-[2-(4-methoxyphenyl)-5-(2-methylpropanoyl)pyrazol-3-yl]phenyl]methylcarbamic acid CAS Name: [4-[2-(4-methoxyphenyl)-5-(2-methyl-1-oxopropyl)-3-pyrazolyl]phenyl]methylcarbamic acid IUPAC Name: [4-[2-(4-methoxyphenyl)-5-(2-methylpropanoyl)pyrazol-3-yl]phenyl]methylcarbamic acid Traditional Name: [4-[5-isobutyryl-2-(4-methoxyphenyl)pyrazol-3-yl]benzyl]carbamic acid Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C1=NN(C(=C1)C2=CC=C(C=C2)CNC(=O)O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)C(=O)C1=NN(C(=C1)C2=CC=C(C=C2)CNC(=O)O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H23N3O4/c1-14(2)21(26)19-12-20(16-6-4-15(5-7-16)13-23-22(27)28)25(24-19)17-8-10-18(29-3)11-9-17/h4-12,14,23H,13H2,1-3H3,(H,27,28)