5-[[1-[(4-chloranyl-3-methyl-phenoxy)methyl]-3,5-dimethyl-pyrazol-4-yl]carbamoyl]-1-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-[[1-[(4-chloranyl-3-methyl-phenoxy)methyl]-3,5-dimethyl-pyrazol-4-yl]carbamoyl]-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 5-[[1-[(4-chloro-3-methyl-phenoxy)methyl]-3,5-dimethyl-pyrazol-4-yl]carbamoyl]-1-methyl-pyrazole-4-carboxylic acid CAS Name: 5-[[[1-[(4-chloro-3-methylphenoxy)methyl]-3,5-dimethyl-4-pyrazolyl]amino]-oxomethyl]-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 5-[[1-[(4-chloro-3-methylphenoxy)methyl]-3,5-dimethylpyrazol-4-yl]carbamoyl]-1-methylpyrazole-4-carboxylic acid Traditional Name: 5-[[1-[(4-chloro-3-methyl-phenoxy)methyl]-3,5-dimethyl-pyrazol-4-yl]carbamoyl]-1-methyl-pyrazole-4-carboxylic acid Formula: C19H20ClN5O4 MolecularWeight: 417.8462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCN2C(=C(C(=N2)C)NC(=O)C3=C(C=NN3C)C(=O)O)C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCN2C(=C(C(=N2)C)NC(=O)C3=C(C=NN3C)C(=O)O)C)Cl

InChI

InChI=1S/C19H20ClN5O4/c1-10-7-13(5-6-15(10)20)29-9-25-12(3)16(11(2)23-25)22-18(26)17-14(19(27)28)8-21-24(17)4/h5-8H,9H2,1-4H3,(H,22,26)(H,27,28)