4-(5-methylcyclohexa-1,5-dien-1-yl)butan-2-one

Systemtic Name: 4-(5-methylcyclohexa-1,5-dien-1-yl)butan-2-one Openeye Name: 4-(5-methylcyclohexa-1,5-dien-1-yl)butan-2-one CAS Name: 4-(5-methyl-1-cyclohexa-1,5-dienyl)-2-butanone IUPAC Name: 4-(5-methylcyclohexa-1,5-dien-1-yl)butan-2-one Traditional Name: 4-(5-methylcyclohexa-1,5-dien-1-yl)butan-2-one Formula: C11H16O MolecularWeight: 164.24414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CCC1)CCC(=O)C

Isomeric SMILES

CC1=CC(=CCC1)CCC(=O)C

InChI

InChI=1S/C11H16O/c1-9-4-3-5-11(8-9)7-6-10(2)12/h5,8H,3-4,6-7H2,1-2H3