(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl 2-(2-hydroxyethylamino)benzoate

Systemtic Name: (5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl 2-(2-hydroxyethylamino)benzoate Openeye Name: (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl 2-(2-hydroxyethylamino)benzoate CAS Name: 2-(2-hydroxyethylamino)benzoic acid (5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methyl ester IUPAC Name: (5-chloro-3-methyl-1-phenylpyrazol-4-yl)methyl 2-(2-hydroxyethylamino)benzoate Traditional Name: 2-(2-hydroxyethylamino)benzoic acid (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl ester Formula: C20H20ClN3O3 MolecularWeight: 385.8441

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1COC(=O)C2=CC=CC=C2NCCO)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1COC(=O)C2=CC=CC=C2NCCO)Cl)C3=CC=CC=C3

InChI

InChI=1S/C20H20ClN3O3/c1-14-17(19(21)24(23-14)15-7-3-2-4-8-15)13-27-20(26)16-9-5-6-10-18(16)22-11-12-25/h2-10,22,25H,11-13H2,1H3