5-cyclopropyl-4-[(Z)-(4,5-dimethylpyrrol-2-ylidene)methyl]-1,2-dihydropyrazol-3-one

Systemtic Name: 5-cyclopropyl-4-[(Z)-(4,5-dimethylpyrrol-2-ylidene)methyl]-1,2-dihydropyrazol-3-one Openeye Name: 5-cyclopropyl-4-[(Z)-(4,5-dimethylpyrrol-2-ylidene)methyl]-1,2-dihydropyrazol-3-one CAS Name: 5-cyclopropyl-4-[(Z)-(4,5-dimethyl-2-pyrrolylidene)methyl]-1,2-dihydropyrazol-3-one IUPAC Name: 5-cyclopropyl-4-[(Z)-(4,5-dimethylpyrrol-2-ylidene)methyl]-1,2-dihydropyrazol-3-one Traditional Name: 5-cyclopropyl-4-[(Z)-(4,5-dimethylpyrrol-2-ylidene)methyl]-3-pyrazolin-3-one Formula: C13H15N3O MolecularWeight: 229.2777

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C(NNC2=O)C3CC3)N=C1C

Isomeric SMILES

CC1=C/C(=C/C2=C(NNC2=O)C3CC3)/N=C1C

InChI

InChI=1S/C13H15N3O/c1-7-5-10(14-8(7)2)6-11-12(9-3-4-9)15-16-13(11)17/h5-6,9H,3-4H2,1-2H3,(H2,15,16,17)/b10-6-