5-[(3S)-3-(4-chlorophenyl)-5-phenyl-1,3-dihydropyrazol-2-yl]-5-oxidanylidene-pentanoate

Systemtic Name: 5-[(3S)-3-(4-chlorophenyl)-5-phenyl-1,3-dihydropyrazol-2-yl]-5-oxidanylidene-pentanoate Openeye Name: 5-[(3S)-3-(4-chlorophenyl)-5-phenyl-1,3-dihydropyrazol-2-yl]-5-oxo-pentanoate CAS Name: 5-[(3S)-3-(4-chlorophenyl)-5-phenyl-1,3-dihydropyrazol-2-yl]-5-oxopentanoate IUPAC Name: 5-[(3S)-3-(4-chlorophenyl)-5-phenyl-1,3-dihydropyrazol-2-yl]-5-oxopentanoate Traditional Name: 5-[(5S)-5-(4-chlorophenyl)-3-phenyl-3-pyrazolin-1-yl]-5-keto-valerate Formula: C20H18ClN2O3- MolecularWeight: 369.82152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(N(N2)C(=O)CCCC(=O)[O-])C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=C[C@H](N(N2)C(=O)CCCC(=O)[O-])C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H19ClN2O3/c21-16-11-9-15(10-12-16)18-13-17(14-5-2-1-3-6-14)22-23(18)19(24)7-4-8-20(25)26/h1-3,5-6,9-13,18,22H,4,7-8H2,(H,25,26)/p-1/t18-/m0/s1