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

Systemtic Name: [4-[2-(4-methoxyphenyl)-5-(2-oxidanylpropan-2-yl)pyrazol-3-yl]phenyl]methylcarbamic acid Openeye Name: [4-[5-(1-hydroxy-1-methyl-ethyl)-2-(4-methoxyphenyl)pyrazol-3-yl]phenyl]methylcarbamic acid CAS Name: [4-[5-(2-hydroxypropan-2-yl)-2-(4-methoxyphenyl)-3-pyrazolyl]phenyl]methylcarbamic acid IUPAC Name: [4-[5-(2-hydroxypropan-2-yl)-2-(4-methoxyphenyl)pyrazol-3-yl]phenyl]methylcarbamic acid Traditional Name: [4-[5-(1-hydroxy-1-methyl-ethyl)-2-(4-methoxyphenyl)pyrazol-3-yl]benzyl]carbamic acid Formula: C21H23N3O4 MolecularWeight: 381.42502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O4/c1-21(2,27)19-12-18(15-6-4-14(5-7-15)13-22-20(25)26)24(23-19)16-8-10-17(28-3)11-9-16/h4-12,22,27H,13H2,1-3H3,(H,25,26)