N-[(3E)-3-(1,2-dihydropyrazol-3-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]propanamide

Systemtic Name: N-[(3E)-3-(1,2-dihydropyrazol-3-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]propanamide Openeye Name: N-[(3E)-3-(1,2-dihydropyrazol-3-ylidene)-4-oxo-cyclohexa-1,5-dien-1-yl]propanamide CAS Name: N-[(3E)-3-(1,2-dihydropyrazol-3-ylidene)-4-oxo-1-cyclohexa-1,5-dienyl]propanamide IUPAC Name: N-[(3E)-3-(1,2-dihydropyrazol-3-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]propanamide Traditional Name: N-[(3E)-4-keto-3-(3-pyrazolin-3-ylidene)cyclohexa-1,5-dien-1-yl]propionamide Formula: C12H13N3O2 MolecularWeight: 231.25052

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=C2C=CNN2)C(=O)C=C1

Isomeric SMILES

CCC(=O)NC1=C/C(=C\2/C=CNN2)/C(=O)C=C1

InChI

InChI=1S/C12H13N3O2/c1-2-12(17)14-8-3-4-11(16)9(7-8)10-5-6-13-15-10/h3-7,13,15H,2H2,1H3,(H,14,17)/b10-9+