(4E)-4-[(2,3-dihydro-1H-inden-2-ylamino)methylidene]-2,5-bis(4-methoxyphenyl)pyrazol-3-one

Systemtic Name: (4E)-4-[(2,3-dihydro-1H-inden-2-ylamino)methylidene]-2,5-bis(4-methoxyphenyl)pyrazol-3-one Openeye Name: (4E)-4-[(indan-2-ylamino)methylene]-2,5-bis(4-methoxyphenyl)pyrazol-3-one CAS Name: (4E)-4-[(2,3-dihydro-1H-inden-2-ylamino)methylidene]-2,5-bis(4-methoxyphenyl)-3-pyrazolone IUPAC Name: (4E)-4-[(2,3-dihydro-1H-inden-2-ylamino)methylidene]-2,5-bis(4-methoxyphenyl)pyrazol-3-one Traditional Name: (4E)-4-[(indan-2-ylamino)methylene]-2,5-bis(4-methoxyphenyl)-2-pyrazolin-3-one Formula: C27H25N3O3 MolecularWeight: 439.5057

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=O)C2=CNC3CC4=CC=CC=C4C3)C5=CC=C(C=C5)OC

Isomeric SMILES

COC1=CC=C(C=C1)C\2=NN(C(=O)/C2=C/NC3CC4=CC=CC=C4C3)C5=CC=C(C=C5)OC

InChI

InChI=1S/C27H25N3O3/c1-32-23-11-7-18(8-12-23)26-25(17-28-21-15-19-5-3-4-6-20(19)16-21)27(31)30(29-26)22-9-13-24(33-2)14-10-22/h3-14,17,21,28H,15-16H2,1-2H3/b25-17+