3-(4-methylcyclohexa-1,4-dien-1-yl)butanoic acid

Systemtic Name: 3-(4-methylcyclohexa-1,4-dien-1-yl)butanoic acid Openeye Name: 3-(4-methylcyclohexa-1,4-dien-1-yl)butanoic acid CAS Name: 3-(4-methyl-1-cyclohexa-1,4-dienyl)butanoic acid IUPAC Name: 3-(4-methylcyclohexa-1,4-dien-1-yl)butanoic acid Traditional Name: 3-(4-methylcyclohexa-1,4-dien-1-yl)butyric acid Formula: C11H16O2 MolecularWeight: 180.24354

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16O2/c1-8-3-5-10(6-4-8)9(2)7-11(12)13/h3,6,9H,4-5,7H2,1-2H3,(H,12,13)