4-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)butan-2-one

Systemtic Name: 4-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)butan-2-one Openeye Name: 4-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)butan-2-one CAS Name: 4-(2,6,6-trimethyl-1-cyclohexa-1,3-dienyl)-2-butanone IUPAC Name: 4-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)butan-2-one Traditional Name: 4-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)butan-2-one Formula: C13H20O MolecularWeight: 192.2973

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CC=C1)(C)C)CCC(=O)C

Isomeric SMILES

CC1=C(C(CC=C1)(C)C)CCC(=O)C

InChI

InChI=1S/C13H20O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h5-6H,7-9H2,1-4H3