[1-(1-dodecoxyethyl)-4-phenyl-cyclohexa-2,5-dien-1-yl] 4-propoxybenzoate

Systemtic Name: [1-(1-dodecoxyethyl)-4-phenyl-cyclohexa-2,5-dien-1-yl] 4-propoxybenzoate Openeye Name: [1-(1-dodecoxyethyl)-4-phenyl-cyclohexa-2,5-dien-1-yl] 4-propoxybenzoate CAS Name: 4-propoxybenzoic acid [1-(1-dodecoxyethyl)-4-phenyl-1-cyclohexa-2,5-dienyl] ester IUPAC Name: [1-(1-dodecoxyethyl)-4-phenylcyclohexa-2,5-dien-1-yl] 4-propoxybenzoate Traditional Name: 4-propoxybenzoic acid [1-(1-lauryloxyethyl)-4-phenyl-cyclohexa-2,5-dien-1-yl] ester Formula: C36H50O4 MolecularWeight: 546.7798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(C)C1(C=CC(C=C1)C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)OCCC

Isomeric SMILES

CCCCCCCCCCCCOC(C)C1(C=CC(C=C1)C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)OCCC

InChI

InChI=1S/C36H50O4/c1-4-6-7-8-9-10-11-12-13-17-29-38-30(3)36(26-24-32(25-27-36)31-18-15-14-16-19-31)40-35(37)33-20-22-34(23-21-33)39-28-5-2/h14-16,18-27,30,32H,4-13,17,28-29H2,1-3H3