1-methyl-5-[[1-[(2-methylphenyl)methyl]pyrazol-4-yl]carbamoyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-methyl-5-[[1-[(2-methylphenyl)methyl]pyrazol-4-yl]carbamoyl]pyrazole-4-carboxylic acid Openeye Name: 1-methyl-5-[[1-(o-tolylmethyl)pyrazol-4-yl]carbamoyl]pyrazole-4-carboxylic acid CAS Name: 1-methyl-5-[[[1-[(2-methylphenyl)methyl]-4-pyrazolyl]amino]-oxomethyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-methyl-5-[[1-[(2-methylphenyl)methyl]pyrazol-4-yl]carbamoyl]pyrazole-4-carboxylic acid Traditional Name: 1-methyl-5-[[1-(2-methylbenzyl)pyrazol-4-yl]carbamoyl]pyrazole-4-carboxylic acid Formula: C17H17N5O3 MolecularWeight: 339.34858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=C(C=N2)NC(=O)C3=C(C=NN3C)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1CN2C=C(C=N2)NC(=O)C3=C(C=NN3C)C(=O)O

InChI

InChI=1S/C17H17N5O3/c1-11-5-3-4-6-12(11)9-22-10-13(7-19-22)20-16(23)15-14(17(24)25)8-18-21(15)2/h3-8,10H,9H2,1-2H3,(H,20,23)(H,24,25)