5-methyl-2-phenyl-pyrazole-3-carboxylic acid; (phenylmethyl) carbamate

Systemtic Name: 5-methyl-2-phenyl-pyrazole-3-carboxylic acid; (phenylmethyl) carbamate Openeye Name: benzyl carbamate; 5-methyl-2-phenyl-pyrazole-3-carboxylic acid CAS Name: carbamic acid (phenylmethyl) ester; 5-methyl-2-phenyl-3-pyrazolecarboxylic acid IUPAC Name: benzyl carbamate; 5-methyl-2-phenylpyrazole-3-carboxylic acid Traditional Name: carbamic acid benzyl ester; 5-methyl-2-phenyl-pyrazole-3-carboxylic acid Formula: C19H19N3O4 MolecularWeight: 353.37186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)O)C2=CC=CC=C2.C1=CC=C(C=C1)COC(=O)N

Isomeric SMILES

CC1=NN(C(=C1)C(=O)O)C2=CC=CC=C2.C1=CC=C(C=C1)COC(=O)N

InChI

InChI=1S/C11H10N2O2.C8H9NO2/c1-8-7-10(11(14)15)13(12-8)9-5-3-2-4-6-9;9-8(10)11-6-7-4-2-1-3-5-7/h2-7H,1H3,(H,14,15);1-5H,6H2,(H2,9,10)