4-(5-pentan-2-yl-1,2,4-oxadiazol-3-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: 4-(5-pentan-2-yl-1,2,4-oxadiazol-3-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: 4-[5-(1-methylbutyl)-1,2,4-oxadiazol-3-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-(5-pentan-2-yl-1,2,4-oxadiazol-3-ylidene)-1-cyclohexa-2,5-dienone IUPAC Name: 4-(5-pentan-2-yl-1,2,4-oxadiazol-3-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: 4-[5-(1-methylbutyl)-1,2,4-oxadiazol-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C13H16N2O2 MolecularWeight: 232.27834

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1=NC(=C2C=CC(=O)C=C2)NO1

Isomeric SMILES

CCCC(C)C1=NC(=C2C=CC(=O)C=C2)NO1

InChI

InChI=1S/C13H16N2O2/c1-3-4-9(2)13-14-12(15-17-13)10-5-7-11(16)8-6-10/h5-9,15H,3-4H2,1-2H3