(4E)-2-(4-methoxyphenyl)-4-[1-(3-oxidanylpropylamino)ethylidene]-5-propyl-pyrazol-3-one

Systemtic Name: (4E)-2-(4-methoxyphenyl)-4-[1-(3-oxidanylpropylamino)ethylidene]-5-propyl-pyrazol-3-one Openeye Name: (4E)-4-[1-(3-hydroxypropylamino)ethylidene]-2-(4-methoxyphenyl)-5-propyl-pyrazol-3-one CAS Name: (4E)-4-[1-(3-hydroxypropylamino)ethylidene]-2-(4-methoxyphenyl)-5-propyl-3-pyrazolone IUPAC Name: (4E)-4-[1-(3-hydroxypropylamino)ethylidene]-2-(4-methoxyphenyl)-5-propylpyrazol-3-one Traditional Name: (4E)-4-[1-(3-hydroxypropylamino)ethylidene]-2-(4-methoxyphenyl)-5-propyl-2-pyrazolin-3-one Formula: C18H25N3O3 MolecularWeight: 331.4094

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=C(C)NCCCO)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCC\1=NN(C(=O)/C1=C(\C)/NCCCO)C2=CC=C(C=C2)OC

InChI

InChI=1S/C18H25N3O3/c1-4-6-16-17(13(2)19-11-5-12-22)18(23)21(20-16)14-7-9-15(24-3)10-8-14/h7-10,19,22H,4-6,11-12H2,1-3H3/b17-13+