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

Systemtic Name: (4Z)-4-[1-(cycloheptylamino)ethylidene]-2-(4-methoxyphenyl)-5-propyl-pyrazol-3-one Openeye Name: (4Z)-4-[1-(cycloheptylamino)ethylidene]-2-(4-methoxyphenyl)-5-propyl-pyrazol-3-one CAS Name: (4Z)-4-[1-(cycloheptylamino)ethylidene]-2-(4-methoxyphenyl)-5-propyl-3-pyrazolone IUPAC Name: (4Z)-4-[1-(cycloheptylamino)ethylidene]-2-(4-methoxyphenyl)-5-propylpyrazol-3-one Traditional Name: (4Z)-4-[1-(cycloheptylamino)ethylidene]-2-(4-methoxyphenyl)-5-propyl-2-pyrazolin-3-one Formula: C22H31N3O2 MolecularWeight: 369.50044

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=C(C)NC2CCCCCC2)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCC\1=NN(C(=O)/C1=C(/C)\NC2CCCCCC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H31N3O2/c1-4-9-20-21(16(2)23-17-10-7-5-6-8-11-17)22(26)25(24-20)18-12-14-19(27-3)15-13-18/h12-15,17,23H,4-11H2,1-3H3/b21-16-