O1-heptyl O2-(3-methylbutyl) benzene-1,2-dicarboxylate

Systemtic Name: O1-heptyl O2-(3-methylbutyl) benzene-1,2-dicarboxylate Openeye Name: O1-heptyl O2-isopentyl benzene-1,2-dicarboxylate CAS Name: benzene-1,2-dicarboxylic acid O1-heptyl ester O2-(3-methylbutyl) ester IUPAC Name: 1-O-heptyl 2-O-(3-methylbutyl) benzene-1,2-dicarboxylate Traditional Name: benzene-1,2-dicarboxylic acid O1-heptyl ester O2-isoamyl ester Formula: C20H30O4 MolecularWeight: 334.4498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCC(C)C

Isomeric SMILES

CCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCC(C)C

InChI

InChI=1S/C20H30O4/c1-4-5-6-7-10-14-23-19(21)17-11-8-9-12-18(17)20(22)24-15-13-16(2)3/h8-9,11-12,16H,4-7,10,13-15H2,1-3H3