diethyl 5-hexyl-3-methyl-6-pentyl-4-phenyl-benzene-1,2-dicarboxylate

Systemtic Name: diethyl 5-hexyl-3-methyl-6-pentyl-4-phenyl-benzene-1,2-dicarboxylate Openeye Name: diethyl 5-hexyl-3-methyl-6-pentyl-4-phenyl-benzene-1,2-dicarboxylate CAS Name: 5-hexyl-3-methyl-6-pentyl-4-phenylbenzene-1,2-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-hexyl-3-methyl-6-pentyl-4-phenylbenzene-1,2-dicarboxylate Traditional Name: 3-amyl-4-hexyl-6-methyl-5-phenyl-benzene-1,2-dicarboxylic acid diethyl ester Formula: C30H42O4 MolecularWeight: 466.65208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C(=C(C(=C1C2=CC=CC=C2)C)C(=O)OCC)C(=O)OCC)CCCCC

Isomeric SMILES

CCCCCCC1=C(C(=C(C(=C1C2=CC=CC=C2)C)C(=O)OCC)C(=O)OCC)CCCCC

InChI

InChI=1S/C30H42O4/c1-6-10-12-17-21-24-25(20-14-11-7-2)28(30(32)34-9-4)27(29(31)33-8-3)22(5)26(24)23-18-15-13-16-19-23/h13,15-16,18-19H,6-12,14,17,20-21H2,1-5H3