(4Z)-2-(4-methoxyphenyl)-4-[1-[(4-phenoxyphenyl)amino]ethylidene]-5-propyl-pyrazol-3-one

Systemtic Name: (4Z)-2-(4-methoxyphenyl)-4-[1-[(4-phenoxyphenyl)amino]ethylidene]-5-propyl-pyrazol-3-one Openeye Name: (4Z)-2-(4-methoxyphenyl)-4-[1-(4-phenoxyanilino)ethylidene]-5-propyl-pyrazol-3-one CAS Name: (4Z)-2-(4-methoxyphenyl)-4-[1-(4-phenoxyanilino)ethylidene]-5-propyl-3-pyrazolone IUPAC Name: (4Z)-2-(4-methoxyphenyl)-4-[1-(4-phenoxyanilino)ethylidene]-5-propylpyrazol-3-one Traditional Name: (4Z)-2-(4-methoxyphenyl)-4-[1-(4-phenoxyanilino)ethylidene]-5-propyl-2-pyrazolin-3-one Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=C(C)NC2=CC=C(C=C2)OC3=CC=CC=C3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCCC\1=NN(C(=O)/C1=C(/C)\NC2=CC=C(C=C2)OC3=CC=CC=C3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H27N3O3/c1-4-8-25-26(27(31)30(29-25)21-13-17-22(32-3)18-14-21)19(2)28-20-11-15-24(16-12-20)33-23-9-6-5-7-10-23/h5-7,9-18,28H,4,8H2,1-3H3/b26-19-