3,5-ditert-butyl-4-pentanoyl-benzaldehyde

Systemtic Name: 3,5-ditert-butyl-4-pentanoyl-benzaldehyde Openeye Name: 3,5-ditert-butyl-4-pentanoyl-benzaldehyde CAS Name: 3,5-ditert-butyl-4-(1-oxopentyl)benzaldehyde IUPAC Name: 3,5-ditert-butyl-4-pentanoylbenzaldehyde Traditional Name: 3,5-ditert-butyl-4-valeryl-benzaldehyde Formula: C20H30O2 MolecularWeight: 302.451

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1=C(C=C(C=C1C(C)(C)C)C=O)C(C)(C)C

Isomeric SMILES

CCCCC(=O)C1=C(C=C(C=C1C(C)(C)C)C=O)C(C)(C)C

InChI

InChI=1S/C20H30O2/c1-8-9-10-17(22)18-15(19(2,3)4)11-14(13-21)12-16(18)20(5,6)7/h11-13H,8-10H2,1-7H3