phenyl 4-propylbenzoate

Systemtic Name: phenyl 4-propylbenzoate Openeye Name: phenyl 4-propylbenzoate CAS Name: 4-propylbenzoic acid phenyl ester IUPAC Name: phenyl 4-propylbenzoate Traditional Name: 4-propylbenzoic acid phenyl ester Formula: C16H16O2 MolecularWeight: 240.29704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2

InChI

InChI=1S/C16H16O2/c1-2-6-13-9-11-14(12-10-13)16(17)18-15-7-4-3-5-8-15/h3-5,7-12H,2,6H2,1H3