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phenyl-[(3R,4S)-2,4,5-triphenyl-3,4-dihydropyrazol-3-yl]methanone

phenyl-[(3R,4S)-2,4,5-triphenyl-3,4-dihydropyrazol-3-yl]methanone

Systemtic Name:phenyl-[(3R,4S)-2,4,5-triphenyl-3,4-dihydropyrazol-3-yl]methanone
Openeye Name:phenyl-[(3R,4S)-2,4,5-triphenyl-3,4-dihydropyrazol-3-yl]methanone
CAS Name:phenyl-[(3R,4S)-2,4,5-triphenyl-3,4-dihydropyrazol-3-yl]methanone
IUPAC Name:phenyl-[(3R,4S)-2,4,5-triphenyl-3,4-dihydropyrazol-3-yl]methanone
Traditional Name:phenyl-[(3R,4S)-2,4,5-triphenyl-2-pyrazolin-3-yl]methanone
Formula: C28H22N2O
MolecularWeight: 402.48708
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C(N(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C(=O)C5=CC=CC=C5


Isomeric SMILES

C1=CC=C(C=C1)[C@H]2[C@@H](N(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C(=O)C5=CC=CC=C5


InChI

InChI=1S/C28H22N2O/c31-28(23-17-9-3-10-18-23)27-25(21-13-5-1-6-14-21)26(22-15-7-2-8-16-22)29-30(27)24-19-11-4-12-20-24/h1-20,25,27H/t25-,27-/m1/s1


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