[4-(1-dodecoxyethyl)phenyl] 4-butoxybenzoate

Systemtic Name: [4-(1-dodecoxyethyl)phenyl] 4-butoxybenzoate Openeye Name: [4-(1-dodecoxyethyl)phenyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [4-(1-dodecoxyethyl)phenyl] ester IUPAC Name: [4-(1-dodecoxyethyl)phenyl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [4-(1-lauryloxyethyl)phenyl] ester Formula: C31H46O4 MolecularWeight: 482.69454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(C)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCCC

Isomeric SMILES

CCCCCCCCCCCCOC(C)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCCC

InChI

InChI=1S/C31H46O4/c1-4-6-8-9-10-11-12-13-14-15-25-33-26(3)27-16-22-30(23-17-27)35-31(32)28-18-20-29(21-19-28)34-24-7-5-2/h16-23,26H,4-15,24-25H2,1-3H3