4-[(E)-indol-3-ylidenemethyl]-5-[(4-phenylphenoxy)methyl]-1,2-dihydropyrazol-3-one

Systemtic Name: 4-[(E)-indol-3-ylidenemethyl]-5-[(4-phenylphenoxy)methyl]-1,2-dihydropyrazol-3-one Openeye Name: 4-[(E)-indol-3-ylidenemethyl]-5-[(4-phenylphenoxy)methyl]-1,2-dihydropyrazol-3-one CAS Name: 4-[(E)-3-indolylidenemethyl]-5-[(4-phenylphenoxy)methyl]-1,2-dihydropyrazol-3-one IUPAC Name: 4-[(E)-indol-3-ylidenemethyl]-5-[(4-phenylphenoxy)methyl]-1,2-dihydropyrazol-3-one Traditional Name: 4-[(E)-indol-3-ylidenemethyl]-5-[(4-phenylphenoxy)methyl]-3-pyrazolin-3-one Formula: C25H19N3O2 MolecularWeight: 393.43726

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)OCC3=C(C(=O)NN3)C=C4C=NC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)OCC3=C(C(=O)NN3)/C=C\4/C=NC5=CC=CC=C54

InChI

InChI=1S/C25H19N3O2/c29-25-22(14-19-15-26-23-9-5-4-8-21(19)23)24(27-28-25)16-30-20-12-10-18(11-13-20)17-6-2-1-3-7-17/h1-15H,16H2,(H2,27,28,29)/b19-14-