3,7-ditert-butyl-2-(4-methylphenyl)-5-phenyl-oxepine

Systemtic Name: 3,7-ditert-butyl-2-(4-methylphenyl)-5-phenyl-oxepine Openeye Name: 3,7-ditert-butyl-5-phenyl-2-(p-tolyl)oxepine CAS Name: 3,7-ditert-butyl-2-(4-methylphenyl)-5-phenyloxepin IUPAC Name: 3,7-ditert-butyl-2-(4-methylphenyl)-5-phenyloxepine Traditional Name: 3,7-ditert-butyl-5-phenyl-2-(p-tolyl)oxepin Formula: C27H32O MolecularWeight: 372.54238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C=C(C=C(O2)C(C)(C)C)C3=CC=CC=C3)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C=C(C=C(O2)C(C)(C)C)C3=CC=CC=C3)C(C)(C)C

InChI

InChI=1S/C27H32O/c1-19-13-15-21(16-14-19)25-23(26(2,3)4)17-22(20-11-9-8-10-12-20)18-24(28-25)27(5,6)7/h8-18H,1-7H3