dimethyl 3-butylbenzene-1,2-dicarboxylate

Systemtic Name: dimethyl 3-butylbenzene-1,2-dicarboxylate Openeye Name: dimethyl 3-butylbenzene-1,2-dicarboxylate CAS Name: 3-butylbenzene-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-butylbenzene-1,2-dicarboxylate Traditional Name: 3-butylbenzene-1,2-dicarboxylic acid dimethyl ester Formula: C14H18O4 MolecularWeight: 250.29032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=CC(=C1C(=O)OC)C(=O)OC

Isomeric SMILES

CCCCC1=CC=CC(=C1C(=O)OC)C(=O)OC

InChI

InChI=1S/C14H18O4/c1-4-5-7-10-8-6-9-11(13(15)17-2)12(10)14(16)18-3/h6,8-9H,4-5,7H2,1-3H3