10-butyl-7,7-dimethyl-3-(2-methyloctan-2-yl)-1-oxidanyl-8,9,10,11-tetrahydrobenzo[d][1]benzoxepin-6-one

Systemtic Name: 10-butyl-7,7-dimethyl-3-(2-methyloctan-2-yl)-1-oxidanyl-8,9,10,11-tetrahydrobenzo[d][1]benzoxepin-6-one Openeye Name: 10-butyl-3-(1,1-dimethylheptyl)-1-hydroxy-7,7-dimethyl-8,9,10,11-tetrahydrobenzo[d][1]benzoxepin-6-one CAS Name: 10-butyl-1-hydroxy-7,7-dimethyl-3-(2-methyloctan-2-yl)-8,9,10,11-tetrahydrobenzo[d][1]benzoxepin-6-one IUPAC Name: 10-butyl-1-hydroxy-7,7-dimethyl-3-(2-methyloctan-2-yl)-8,9,10,11-tetrahydrobenzo[d][1]benzoxepin-6-one Traditional Name: 10-butyl-3-(1,1-dimethylheptyl)-1-hydroxy-7,7-dimethyl-8,9,10,11-tetrahydrobenzo[d][1]benzoxepin-6-one Formula: C29H44O3 MolecularWeight: 440.65786

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=CC2=C(C3=C(CCC(C3)CCCC)C(C(=O)O2)(C)C)C(=C1)O

Isomeric SMILES

CCCCCCC(C)(C)C1=CC2=C(C3=C(CCC(C3)CCCC)C(C(=O)O2)(C)C)C(=C1)O

InChI

InChI=1S/C29H44O3/c1-7-9-11-12-16-28(3,4)21-18-24(30)26-22-17-20(13-10-8-2)14-15-23(22)29(5,6)27(31)32-25(26)19-21/h18-20,30H,7-17H2,1-6H3