3-tert-butyl-1,1,4-trimethyl-isochromene

Systemtic Name: 3-tert-butyl-1,1,4-trimethyl-isochromene Openeye Name: 3-tert-butyl-1,1,4-trimethyl-isochromene CAS Name: 3-tert-butyl-1,1,4-trimethyl-2-benzopyran IUPAC Name: 3-tert-butyl-1,1,4-trimethylisochromene Traditional Name: 3-tert-butyl-1,1,4-trimethyl-isochromene Formula: C16H22O MolecularWeight: 230.34528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(C2=CC=CC=C12)(C)C)C(C)(C)C

Isomeric SMILES

CC1=C(OC(C2=CC=CC=C12)(C)C)C(C)(C)C

InChI

InChI=1S/C16H22O/c1-11-12-9-7-8-10-13(12)16(5,6)17-14(11)15(2,3)4/h7-10H,1-6H3