ethyl 5-[(4-dimethylaminophenyl)-oxidanyl-methyl]-4-methyl-1H-pyrazole-3-carboxylate

Systemtic Name: ethyl 5-[(4-dimethylaminophenyl)-oxidanyl-methyl]-4-methyl-1H-pyrazole-3-carboxylate Openeye Name: ethyl 5-[(4-dimethylaminophenyl)-hydroxy-methyl]-4-methyl-1H-pyrazole-3-carboxylate CAS Name: 5-[(4-dimethylaminophenyl)-hydroxymethyl]-4-methyl-1H-pyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-dimethylaminophenyl)-hydroxymethyl]-4-methyl-1H-pyrazole-3-carboxylate Traditional Name: 5-[(4-dimethylaminophenyl)-hydroxy-methyl]-4-methyl-1H-pyrazole-3-carboxylic acid ethyl ester Formula: C16H21N3O3 MolecularWeight: 303.35624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NNC(=C1C)C(C2=CC=C(C=C2)N(C)C)O

Isomeric SMILES

CCOC(=O)C1=NNC(=C1C)C(C2=CC=C(C=C2)N(C)C)O

InChI

InChI=1S/C16H21N3O3/c1-5-22-16(21)14-10(2)13(17-18-14)15(20)11-6-8-12(9-7-11)19(3)4/h6-9,15,20H,5H2,1-4H3,(H,17,18)