[4,4-dibutoxy-6,6-bis(oxidanyl)cyclohex-2-en-1-yl]-phenyl-methanone

Systemtic Name: [4,4-dibutoxy-6,6-bis(oxidanyl)cyclohex-2-en-1-yl]-phenyl-methanone Openeye Name: (4,4-dibutoxy-6,6-dihydroxy-cyclohex-2-en-1-yl)-phenyl-methanone CAS Name: (4,4-dibutoxy-6,6-dihydroxy-1-cyclohex-2-enyl)-phenylmethanone IUPAC Name: (4,4-dibutoxy-6,6-dihydroxycyclohex-2-en-1-yl)-phenylmethanone Traditional Name: (4,4-dibutoxy-6,6-dihydroxy-cyclohex-2-en-1-yl)-phenyl-methanone Formula: C21H30O5 MolecularWeight: 362.4599

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1(CC(C(C=C1)C(=O)C2=CC=CC=C2)(O)O)OCCCC

Isomeric SMILES

CCCCOC1(CC(C(C=C1)C(=O)C2=CC=CC=C2)(O)O)OCCCC

InChI

InChI=1S/C21H30O5/c1-3-5-14-25-20(26-15-6-4-2)13-12-18(21(23,24)16-20)19(22)17-10-8-7-9-11-17/h7-13,18,23-24H,3-6,14-16H2,1-2H3