[4-[4-(1-methoxyethyl)phenyl]phenyl] 4-pentadecoxybenzoate

Systemtic Name: [4-[4-(1-methoxyethyl)phenyl]phenyl] 4-pentadecoxybenzoate Openeye Name: [4-[4-(1-methoxyethyl)phenyl]phenyl] 4-pentadecoxybenzoate CAS Name: 4-pentadecoxybenzoic acid [4-[4-(1-methoxyethyl)phenyl]phenyl] ester IUPAC Name: [4-[4-(1-methoxyethyl)phenyl]phenyl] 4-pentadecoxybenzoate Traditional Name: 4-pentadecoxybenzoic acid [4-[4-(1-methoxyethyl)phenyl]phenyl] ester Formula: C37H50O4 MolecularWeight: 558.7905

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C(C)OC

Isomeric SMILES

CCCCCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C(C)OC

InChI

InChI=1S/C37H50O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-29-40-35-25-23-34(24-26-35)37(38)41-36-27-21-33(22-28-36)32-19-17-31(18-20-32)30(2)39-3/h17-28,30H,4-16,29H2,1-3H3