[2-[(3S)-3-(4-bromophenyl)-2-ethanoyl-1,3-dihydropyrazol-5-yl]phenyl] ethanoate

Systemtic Name: [2-[(3S)-3-(4-bromophenyl)-2-ethanoyl-1,3-dihydropyrazol-5-yl]phenyl] ethanoate Openeye Name: [2-[(3S)-2-acetyl-3-(4-bromophenyl)-1,3-dihydropyrazol-5-yl]phenyl] acetate CAS Name: acetic acid [2-[(3S)-2-acetyl-3-(4-bromophenyl)-1,3-dihydropyrazol-5-yl]phenyl] ester IUPAC Name: [2-[(3S)-2-acetyl-3-(4-bromophenyl)-1,3-dihydropyrazol-5-yl]phenyl] acetate Traditional Name: acetic acid [2-[(5S)-1-acetyl-5-(4-bromophenyl)-3-pyrazolin-3-yl]phenyl] ester Formula: C19H17BrN2O3 MolecularWeight: 401.25388

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(C=C(N1)C2=CC=CC=C2OC(=O)C)C3=CC=C(C=C3)Br

Isomeric SMILES

CC(=O)N1[C@@H](C=C(N1)C2=CC=CC=C2OC(=O)C)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H17BrN2O3/c1-12(23)22-18(14-7-9-15(20)10-8-14)11-17(21-22)16-5-3-4-6-19(16)25-13(2)24/h3-11,18,21H,1-2H3/t18-/m0/s1