O1-(8-methylnonyl) O3-(phenylmethyl) benzene-1,3-dicarboxylate

Systemtic Name: O1-(8-methylnonyl) O3-(phenylmethyl) benzene-1,3-dicarboxylate Openeye Name: O3-benzyl O1-(8-methylnonyl) benzene-1,3-dicarboxylate CAS Name: benzene-1,3-dicarboxylic acid O1-(8-methylnonyl) ester O3-(phenylmethyl) ester IUPAC Name: 3-O-benzyl 1-O-(8-methylnonyl) benzene-1,3-dicarboxylate Traditional Name: benzene-1,3-dicarboxylic acid O3-benzyl ester O1-(8-methylnonyl) ester Formula: C25H32O4 MolecularWeight: 396.51918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCOC(=O)C1=CC=CC(=C1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)CCCCCCCOC(=O)C1=CC=CC(=C1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C25H32O4/c1-20(2)12-7-4-3-5-10-17-28-24(26)22-15-11-16-23(18-22)25(27)29-19-21-13-8-6-9-14-21/h6,8-9,11,13-16,18,20H,3-5,7,10,12,17,19H2,1-2H3