O1-butyl O3-(phenylmethyl) benzene-1,3-dicarboxylate

Systemtic Name: O1-butyl O3-(phenylmethyl) benzene-1,3-dicarboxylate Openeye Name: O3-benzyl O1-butyl benzene-1,3-dicarboxylate CAS Name: benzene-1,3-dicarboxylic acid O1-butyl ester O3-(phenylmethyl) ester IUPAC Name: 3-O-benzyl 1-O-butyl benzene-1,3-dicarboxylate Traditional Name: benzene-1,3-dicarboxylic acid O3-benzyl ester O1-butyl ester Formula: C19H20O4 MolecularWeight: 312.3597

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20O4/c1-2-3-12-22-18(20)16-10-7-11-17(13-16)19(21)23-14-15-8-5-4-6-9-15/h4-11,13H,2-3,12,14H2,1H3