tert-butyl N-[4-[4-(2-hydroxyethyl)-3-methyl-5-oxidanylidene-4H-pyrazol-1-yl]phenyl]carbamate

Systemtic Name: tert-butyl N-[4-[4-(2-hydroxyethyl)-3-methyl-5-oxidanylidene-4H-pyrazol-1-yl]phenyl]carbamate Openeye Name: tert-butyl N-[4-[4-(2-hydroxyethyl)-3-methyl-5-oxo-4H-pyrazol-1-yl]phenyl]carbamate CAS Name: N-[4-[4-(2-hydroxyethyl)-3-methyl-5-oxo-4H-pyrazol-1-yl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[4-(2-hydroxyethyl)-3-methyl-5-oxo-4H-pyrazol-1-yl]phenyl]carbamate Traditional Name: N-[4-[4-(2-hydroxyethyl)-5-keto-3-methyl-2-pyrazolin-1-yl]phenyl]carbamic acid tert-butyl ester Formula: C17H23N3O4 MolecularWeight: 333.38222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1CCO)C2=CC=C(C=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=NN(C(=O)C1CCO)C2=CC=C(C=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C17H23N3O4/c1-11-14(9-10-21)15(22)20(19-11)13-7-5-12(6-8-13)18-16(23)24-17(2,3)4/h5-8,14,21H,9-10H2,1-4H3,(H,18,23)