5-[[1-[(3-chlorophenyl)methyl]pyrazol-4-yl]carbamoyl]-1-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-[[1-[(3-chlorophenyl)methyl]pyrazol-4-yl]carbamoyl]-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 5-[[1-[(3-chlorophenyl)methyl]pyrazol-4-yl]carbamoyl]-1-methyl-pyrazole-4-carboxylic acid CAS Name: 5-[[[1-[(3-chlorophenyl)methyl]-4-pyrazolyl]amino]-oxomethyl]-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 5-[[1-[(3-chlorophenyl)methyl]pyrazol-4-yl]carbamoyl]-1-methylpyrazole-4-carboxylic acid Traditional Name: 5-[[1-(3-chlorobenzyl)pyrazol-4-yl]carbamoyl]-1-methyl-pyrazole-4-carboxylic acid Formula: C16H14ClN5O3 MolecularWeight: 359.76706

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)O)C(=O)NC2=CN(N=C2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CN1C(=C(C=N1)C(=O)O)C(=O)NC2=CN(N=C2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C16H14ClN5O3/c1-21-14(13(7-18-21)16(24)25)15(23)20-12-6-19-22(9-12)8-10-3-2-4-11(17)5-10/h2-7,9H,8H2,1H3,(H,20,23)(H,24,25)