2-butyl-3-methyl-4-pyridin-2-yl-cyclobut-2-en-1-one

Systemtic Name: 2-butyl-3-methyl-4-pyridin-2-yl-cyclobut-2-en-1-one Openeye Name: 2-butyl-3-methyl-4-(2-pyridyl)cyclobut-2-en-1-one CAS Name: 2-butyl-3-methyl-4-(2-pyridinyl)-1-cyclobut-2-enone IUPAC Name: 2-butyl-3-methyl-4-pyridin-2-ylcyclobut-2-en-1-one Traditional Name: 2-butyl-3-methyl-4-(2-pyridyl)cyclobut-2-en-1-one Formula: C14H17NO MolecularWeight: 215.29088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(C1=O)C2=CC=CC=N2)C

Isomeric SMILES

CCCCC1=C(C(C1=O)C2=CC=CC=N2)C

InChI

InChI=1S/C14H17NO/c1-3-4-7-11-10(2)13(14(11)16)12-8-5-6-9-15-12/h5-6,8-9,13H,3-4,7H2,1-2H3