3-[(3R)-3-(2,5-dimethylphenyl)-2-phenyl-3,4-dihydropyrazol-5-yl]chromen-2-one

Systemtic Name: 3-[(3R)-3-(2,5-dimethylphenyl)-2-phenyl-3,4-dihydropyrazol-5-yl]chromen-2-one Openeye Name: 3-[(3R)-3-(2,5-dimethylphenyl)-2-phenyl-3,4-dihydropyrazol-5-yl]chromen-2-one CAS Name: 3-[(3R)-3-(2,5-dimethylphenyl)-2-phenyl-3,4-dihydropyrazol-5-yl]-1-benzopyran-2-one IUPAC Name: 3-[(3R)-3-(2,5-dimethylphenyl)-2-phenyl-3,4-dihydropyrazol-5-yl]chromen-2-one Traditional Name: 3-[(5R)-5-(2,5-dimethylphenyl)-1-phenyl-2-pyrazolin-3-yl]coumarin Formula: C26H22N2O2 MolecularWeight: 394.46508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2CC(=NN2C3=CC=CC=C3)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

CC1=CC(=C(C=C1)C)[C@H]2CC(=NN2C3=CC=CC=C3)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C26H22N2O2/c1-17-12-13-18(2)21(14-17)24-16-23(27-28(24)20-9-4-3-5-10-20)22-15-19-8-6-7-11-25(19)30-26(22)29/h3-15,24H,16H2,1-2H3/t24-/m1/s1