2-[4-(2-methyloctan-2-yl)-2-phenylmethoxy-phenyl]-4-oxidanyl-cyclohexane-1-carbaldehyde

Systemtic Name: 2-[4-(2-methyloctan-2-yl)-2-phenylmethoxy-phenyl]-4-oxidanyl-cyclohexane-1-carbaldehyde Openeye Name: 2-[2-benzyloxy-4-(1,1-dimethylheptyl)phenyl]-4-hydroxy-cyclohexanecarbaldehyde CAS Name: 4-hydroxy-2-[4-(2-methyloctan-2-yl)-2-phenylmethoxyphenyl]-1-cyclohexanecarboxaldehyde IUPAC Name: 4-hydroxy-2-[4-(2-methyloctan-2-yl)-2-phenylmethoxyphenyl]cyclohexane-1-carbaldehyde Traditional Name: 2-[2-benzoxy-4-(1,1-dimethylheptyl)phenyl]-4-hydroxy-cyclohexanecarbaldehyde Formula: C29H40O3 MolecularWeight: 436.6261

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CC(CCC2C=O)O)OCC3=CC=CC=C3

Isomeric SMILES

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CC(CCC2C=O)O)OCC3=CC=CC=C3

InChI

InChI=1S/C29H40O3/c1-4-5-6-10-17-29(2,3)24-14-16-26(27-19-25(31)15-13-23(27)20-30)28(18-24)32-21-22-11-8-7-9-12-22/h7-9,11-12,14,16,18,20,23,25,27,31H,4-6,10,13,15,17,19,21H2,1-3H3