3-(3,5-ditert-butylcyclohexa-1,5-dien-1-yl)propanoate

Systemtic Name: 3-(3,5-ditert-butylcyclohexa-1,5-dien-1-yl)propanoate Openeye Name: 3-(3,5-ditert-butylcyclohexa-1,5-dien-1-yl)propanoate CAS Name: 3-(3,5-ditert-butyl-1-cyclohexa-1,5-dienyl)propanoate IUPAC Name: 3-(3,5-ditert-butylcyclohexa-1,5-dien-1-yl)propanoate Traditional Name: 3-(3,5-ditert-butylcyclohexa-1,5-dien-1-yl)propionate Formula: C17H27O2- MolecularWeight: 263.39508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CC(=CC(=C1)CCC(=O)[O-])C(C)(C)C

Isomeric SMILES

CC(C)(C)C1CC(=CC(=C1)CCC(=O)[O-])C(C)(C)C

InChI

InChI=1S/C17H28O2/c1-16(2,3)13-9-12(7-8-15(18)19)10-14(11-13)17(4,5)6/h9-10,13H,7-8,11H2,1-6H3,(H,18,19)/p-1