4,6-dihexyl-6-methyl-cyclohexa-1,3-diene-1-carbaldehyde

Systemtic Name: 4,6-dihexyl-6-methyl-cyclohexa-1,3-diene-1-carbaldehyde Openeye Name: 4,6-dihexyl-6-methyl-cyclohexa-1,3-diene-1-carbaldehyde CAS Name: 4,6-dihexyl-6-methyl-1-cyclohexa-1,3-dienecarboxaldehyde IUPAC Name: 4,6-dihexyl-6-methylcyclohexa-1,3-diene-1-carbaldehyde Traditional Name: 4,6-dihexyl-6-methyl-cyclohexa-1,3-diene-1-carbaldehyde Formula: C20H34O MolecularWeight: 290.48336

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C(C1)(C)CCCCCC)C=O

Isomeric SMILES

CCCCCCC1=CC=C(C(C1)(C)CCCCCC)C=O

InChI

InChI=1S/C20H34O/c1-4-6-8-10-12-18-13-14-19(17-21)20(3,16-18)15-11-9-7-5-2/h13-14,17H,4-12,15-16H2,1-3H3