(2-propoxyphenyl) 4-(1-nonoxyethyl)benzoate

Systemtic Name: (2-propoxyphenyl) 4-(1-nonoxyethyl)benzoate Openeye Name: (2-propoxyphenyl) 4-(1-nonoxyethyl)benzoate CAS Name: 4-(1-nonoxyethyl)benzoic acid (2-propoxyphenyl) ester IUPAC Name: (2-propoxyphenyl) 4-(1-nonoxyethyl)benzoate Traditional Name: 4-(1-nonoxyethyl)benzoic acid (2-propoxyphenyl) ester Formula: C27H38O4 MolecularWeight: 426.58822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC(C)C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2OCCC

Isomeric SMILES

CCCCCCCCCOC(C)C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2OCCC

InChI

InChI=1S/C27H38O4/c1-4-6-7-8-9-10-13-21-29-22(3)23-16-18-24(19-17-23)27(28)31-26-15-12-11-14-25(26)30-20-5-2/h11-12,14-19,22H,4-10,13,20-21H2,1-3H3