[4-[4-(1-decoxyethyl)phenyl]phenyl] 4-hexoxybenzoate

Systemtic Name: [4-[4-(1-decoxyethyl)phenyl]phenyl] 4-hexoxybenzoate Openeye Name: [4-[4-(1-decoxyethyl)phenyl]phenyl] 4-hexoxybenzoate CAS Name: 4-hexoxybenzoic acid [4-[4-(1-decoxyethyl)phenyl]phenyl] ester IUPAC Name: [4-[4-(1-decoxyethyl)phenyl]phenyl] 4-hexoxybenzoate Traditional Name: 4-hexoxybenzoic acid [4-[4-(1-decoxyethyl)phenyl]phenyl] ester Formula: C37H50O4 MolecularWeight: 558.7905

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)OCCCCCC

Isomeric SMILES

CCCCCCCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)OCCCCCC

InChI

InChI=1S/C37H50O4/c1-4-6-8-10-11-12-13-15-28-39-30(3)31-16-18-32(19-17-31)33-20-26-36(27-21-33)41-37(38)34-22-24-35(25-23-34)40-29-14-9-7-5-2/h16-27,30H,4-15,28-29H2,1-3H3