4-[(Z)-(4-ethyl-3,5-dimethyl-pyrrol-2-ylidene)methyl]-5-(oxolan-3-yl)-1,2-dihydropyrazol-3-one

Systemtic Name: 4-[(Z)-(4-ethyl-3,5-dimethyl-pyrrol-2-ylidene)methyl]-5-(oxolan-3-yl)-1,2-dihydropyrazol-3-one Openeye Name: 4-[(Z)-(4-ethyl-3,5-dimethyl-pyrrol-2-ylidene)methyl]-5-tetrahydrofuran-3-yl-1,2-dihydropyrazol-3-one CAS Name: 4-[(Z)-(4-ethyl-3,5-dimethyl-2-pyrrolylidene)methyl]-5-(3-oxolanyl)-1,2-dihydropyrazol-3-one IUPAC Name: 4-[(Z)-(4-ethyl-3,5-dimethylpyrrol-2-ylidene)methyl]-5-(oxolan-3-yl)-1,2-dihydropyrazol-3-one Traditional Name: 4-[(Z)-(4-ethyl-3,5-dimethyl-pyrrol-2-ylidene)methyl]-5-tetrahydrofuran-3-yl-3-pyrazolin-3-one Formula: C16H21N3O2 MolecularWeight: 287.35684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC2=C(NNC2=O)C3CCOC3)N=C1C)C

Isomeric SMILES

CCC1=C(/C(=C/C2=C(NNC2=O)C3CCOC3)/N=C1C)C

InChI

InChI=1S/C16H21N3O2/c1-4-12-9(2)14(17-10(12)3)7-13-15(18-19-16(13)20)11-5-6-21-8-11/h7,11H,4-6,8H2,1-3H3,(H2,18,19,20)/b14-7-