3,5-bis(2-methylhexan-2-yl)-4-oxidanyl-benzaldehyde

Systemtic Name: 3,5-bis(2-methylhexan-2-yl)-4-oxidanyl-benzaldehyde Openeye Name: 3,5-bis(1,1-dimethylpentyl)-4-hydroxy-benzaldehyde CAS Name: 4-hydroxy-3,5-bis(2-methylhexan-2-yl)benzaldehyde IUPAC Name: 4-hydroxy-3,5-bis(2-methylhexan-2-yl)benzaldehyde Traditional Name: 3,5-bis(1,1-dimethylpentyl)-4-hydroxy-benzaldehyde Formula: C21H34O2 MolecularWeight: 318.49346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C)C1=CC(=CC(=C1O)C(C)(C)CCCC)C=O

Isomeric SMILES

CCCCC(C)(C)C1=CC(=CC(=C1O)C(C)(C)CCCC)C=O

InChI

InChI=1S/C21H34O2/c1-7-9-11-20(3,4)17-13-16(15-22)14-18(19(17)23)21(5,6)12-10-8-2/h13-15,23H,7-12H2,1-6H3