N-[[4-[2-(4-methoxyphenyl)-5-(2-oxidanylpropan-2-yl)pyrazol-3-yl]phenyl]methyl]carbamate

Systemtic Name: N-[[4-[2-(4-methoxyphenyl)-5-(2-oxidanylpropan-2-yl)pyrazol-3-yl]phenyl]methyl]carbamate Openeye Name: N-[[4-[5-(1-hydroxy-1-methyl-ethyl)-2-(4-methoxyphenyl)pyrazol-3-yl]phenyl]methyl]carbamate CAS Name: N-[[4-[5-(2-hydroxypropan-2-yl)-2-(4-methoxyphenyl)-3-pyrazolyl]phenyl]methyl]carbamate IUPAC Name: N-[[4-[5-(2-hydroxypropan-2-yl)-2-(4-methoxyphenyl)pyrazol-3-yl]phenyl]methyl]carbamate Traditional Name: N-[4-[5-(1-hydroxy-1-methyl-ethyl)-2-(4-methoxyphenyl)pyrazol-3-yl]benzyl]carbamate Formula: C21H22N3O4- MolecularWeight: 380.41708

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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)/p-1