3-methoxy-6-methyl-5-[4-(2-methyloctan-2-yl)-2-phenylmethoxy-phenyl]cyclohex-2-en-1-one

Systemtic Name: 3-methoxy-6-methyl-5-[4-(2-methyloctan-2-yl)-2-phenylmethoxy-phenyl]cyclohex-2-en-1-one Openeye Name: 5-[2-benzyloxy-4-(1,1-dimethylheptyl)phenyl]-3-methoxy-6-methyl-cyclohex-2-en-1-one CAS Name: 3-methoxy-6-methyl-5-[4-(2-methyloctan-2-yl)-2-phenylmethoxyphenyl]-1-cyclohex-2-enone IUPAC Name: 3-methoxy-6-methyl-5-[4-(2-methyloctan-2-yl)-2-phenylmethoxyphenyl]cyclohex-2-en-1-one Traditional Name: 5-[2-benzoxy-4-(1,1-dimethylheptyl)phenyl]-3-methoxy-6-methyl-cyclohex-2-en-1-one Formula: C30H40O3 MolecularWeight: 448.6368

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CC(=CC(=O)C2C)OC)OCC3=CC=CC=C3

Isomeric SMILES

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CC(=CC(=O)C2C)OC)OCC3=CC=CC=C3

InChI

InChI=1S/C30H40O3/c1-6-7-8-12-17-30(3,4)24-15-16-26(27-19-25(32-5)20-28(31)22(27)2)29(18-24)33-21-23-13-10-9-11-14-23/h9-11,13-16,18,20,22,27H,6-8,12,17,19,21H2,1-5H3