[1-acetyloxy-6,6-dimethyl-3-(2-methyloctan-2-yl)benzo[c]chromen-9-yl]methyl ethanoate

Systemtic Name: [1-acetyloxy-6,6-dimethyl-3-(2-methyloctan-2-yl)benzo[c]chromen-9-yl]methyl ethanoate Openeye Name: [1-acetoxy-3-(1,1-dimethylheptyl)-6,6-dimethyl-benzo[c]chromen-9-yl]methyl acetate CAS Name: acetic acid [1-acetyloxy-6,6-dimethyl-3-(2-methyloctan-2-yl)-9-benzo[c][1]benzopyranyl]methyl ester IUPAC Name: [1-acetyloxy-6,6-dimethyl-3-(2-methyloctan-2-yl)benzo[c]chromen-9-yl]methyl acetate Traditional Name: acetic acid [1-acetoxy-3-(1,1-dimethylheptyl)-6,6-dimethyl-benzo[c]chromen-9-yl]methyl ester Formula: C29H38O5 MolecularWeight: 466.60902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=CC2=C(C(=C1)OC(=O)C)C3=C(C=CC(=C3)COC(=O)C)C(O2)(C)C

Isomeric SMILES

CCCCCCC(C)(C)C1=CC2=C(C(=C1)OC(=O)C)C3=C(C=CC(=C3)COC(=O)C)C(O2)(C)C

InChI

InChI=1S/C29H38O5/c1-8-9-10-11-14-28(4,5)22-16-25(33-20(3)31)27-23-15-21(18-32-19(2)30)12-13-24(23)29(6,7)34-26(27)17-22/h12-13,15-17H,8-11,14,18H2,1-7H3