2-[[(3S)-3-(2-hydroxyphenyl)-5-phenyl-1,3-dihydropyrazol-2-yl]carbonyl]benzoate

Systemtic Name: 2-[[(3S)-3-(2-hydroxyphenyl)-5-phenyl-1,3-dihydropyrazol-2-yl]carbonyl]benzoate Openeye Name: 2-[(3S)-3-(2-hydroxyphenyl)-5-phenyl-1,3-dihydropyrazole-2-carbonyl]benzoate CAS Name: 2-[[(3S)-3-(2-hydroxyphenyl)-5-phenyl-1,3-dihydropyrazol-2-yl]-oxomethyl]benzoate IUPAC Name: 2-[(3S)-3-(2-hydroxyphenyl)-5-phenyl-1,3-dihydropyrazole-2-carbonyl]benzoate Traditional Name: 2-[(5S)-5-(2-hydroxyphenyl)-3-phenyl-3-pyrazoline-1-carbonyl]benzoate Formula: C23H17N2O4- MolecularWeight: 385.39208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(N(N2)C(=O)C3=CC=CC=C3C(=O)[O-])C4=CC=CC=C4O

Isomeric SMILES

C1=CC=C(C=C1)C2=C[C@H](N(N2)C(=O)C3=CC=CC=C3C(=O)[O-])C4=CC=CC=C4O

InChI

InChI=1S/C23H18N2O4/c26-21-13-7-6-12-18(21)20-14-19(15-8-2-1-3-9-15)24-25(20)22(27)16-10-4-5-11-17(16)23(28)29/h1-14,20,24,26H,(H,28,29)/p-1/t20-/m0/s1