4-[5-azanyl-4-(4-chlorophenyl)-3-methyl-pyrazol-1-yl]benzoic acid

Systemtic Name: 4-[5-azanyl-4-(4-chlorophenyl)-3-methyl-pyrazol-1-yl]benzoic acid Openeye Name: 4-[5-amino-4-(4-chlorophenyl)-3-methyl-pyrazol-1-yl]benzoic acid CAS Name: 4-[5-amino-4-(4-chlorophenyl)-3-methyl-1-pyrazolyl]benzoic acid IUPAC Name: 4-[5-amino-4-(4-chlorophenyl)-3-methylpyrazol-1-yl]benzoic acid Traditional Name: 4-[5-amino-4-(4-chlorophenyl)-3-methyl-pyrazol-1-yl]benzoic acid Formula: C17H14ClN3O2 MolecularWeight: 327.76496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C2=CC=C(C=C2)Cl)N)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=NN(C(=C1C2=CC=C(C=C2)Cl)N)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C17H14ClN3O2/c1-10-15(11-2-6-13(18)7-3-11)16(19)21(20-10)14-8-4-12(5-9-14)17(22)23/h2-9H,19H2,1H3,(H,22,23)