2-[3-(butylamino)-5-(4-chlorophenyl)-1H-pyrazol-4-yl]ethanoic acid

Systemtic Name: 2-[3-(butylamino)-5-(4-chlorophenyl)-1H-pyrazol-4-yl]ethanoic acid Openeye Name: 2-[3-(butylamino)-5-(4-chlorophenyl)-1H-pyrazol-4-yl]acetic acid CAS Name: 2-[3-(butylamino)-5-(4-chlorophenyl)-1H-pyrazol-4-yl]acetic acid IUPAC Name: 2-[3-(butylamino)-5-(4-chlorophenyl)-1H-pyrazol-4-yl]acetic acid Traditional Name: 2-[3-(butylamino)-5-(4-chlorophenyl)-1H-pyrazol-4-yl]acetic acid Formula: C15H18ClN3O2 MolecularWeight: 307.77532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NNC(=C1CC(=O)O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCNC1=NNC(=C1CC(=O)O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H18ClN3O2/c1-2-3-8-17-15-12(9-13(20)21)14(18-19-15)10-4-6-11(16)7-5-10/h4-7H,2-3,8-9H2,1H3,(H,20,21)(H2,17,18,19)