2-[[1-[(2,4-dichlorophenyl)methyl]pyrazol-4-yl]carbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: 2-[[1-[(2,4-dichlorophenyl)methyl]pyrazol-4-yl]carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: 2-[[1-[(2,4-dichlorophenyl)methyl]pyrazol-4-yl]carbamoyl]cyclohexanecarboxylic acid CAS Name: 2-[[[1-[(2,4-dichlorophenyl)methyl]-4-pyrazolyl]amino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 2-[[1-[(2,4-dichlorophenyl)methyl]pyrazol-4-yl]carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: 2-[[1-(2,4-dichlorobenzyl)pyrazol-4-yl]carbamoyl]cyclohexanecarboxylic acid Formula: C18H19Cl2N3O3 MolecularWeight: 396.26776

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NC2=CN(N=C2)CC3=C(C=C(C=C3)Cl)Cl)C(=O)O

Isomeric SMILES

C1CCC(C(C1)C(=O)NC2=CN(N=C2)CC3=C(C=C(C=C3)Cl)Cl)C(=O)O

InChI

InChI=1S/C18H19Cl2N3O3/c19-12-6-5-11(16(20)7-12)9-23-10-13(8-21-23)22-17(24)14-3-1-2-4-15(14)18(25)26/h5-8,10,14-15H,1-4,9H2,(H,22,24)(H,25,26)