[4-(2-methylpropoxycarbonyl)phenyl] 3-propoxybenzoate

Systemtic Name: [4-(2-methylpropoxycarbonyl)phenyl] 3-propoxybenzoate Openeye Name: (4-isobutoxycarbonylphenyl) 3-propoxybenzoate CAS Name: 3-propoxybenzoic acid [4-[2-methylpropoxy(oxo)methyl]phenyl] ester IUPAC Name: [4-(2-methylpropoxycarbonyl)phenyl] 3-propoxybenzoate Traditional Name: 3-propoxybenzoic acid (4-isobutoxycarbonylphenyl) ester Formula: C21H24O5 MolecularWeight: 356.41226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)OC2=CC=C(C=C2)C(=O)OCC(C)C

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)OC2=CC=C(C=C2)C(=O)OCC(C)C

InChI

InChI=1S/C21H24O5/c1-4-12-24-19-7-5-6-17(13-19)21(23)26-18-10-8-16(9-11-18)20(22)25-14-15(2)3/h5-11,13,15H,4,12,14H2,1-3H3