3-methyl-2-(2-methylpropyl)-2,3,6,7-tetrahydrooxepine

Systemtic Name: 3-methyl-2-(2-methylpropyl)-2,3,6,7-tetrahydrooxepine Openeye Name: 2-isobutyl-3-methyl-2,3,6,7-tetrahydrooxepine CAS Name: 3-methyl-2-(2-methylpropyl)-2,3,6,7-tetrahydrooxepin IUPAC Name: 3-methyl-2-(2-methylpropyl)-2,3,6,7-tetrahydrooxepine Traditional Name: 2-isobutyl-3-methyl-2,3,6,7-tetrahydrooxepin Formula: C11H20O MolecularWeight: 168.2759

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CCCOC1CC(C)C

Isomeric SMILES

CC1C=CCCOC1CC(C)C

InChI

InChI=1S/C11H20O/c1-9(2)8-11-10(3)6-4-5-7-12-11/h4,6,9-11H,5,7-8H2,1-3H3