[4-[(2S)-2-methyloctoxy]phenyl] 4-decoxybenzoate

Systemtic Name: [4-[(2S)-2-methyloctoxy]phenyl] 4-decoxybenzoate Openeye Name: [4-[(2S)-2-methyloctoxy]phenyl] 4-decoxybenzoate CAS Name: 4-decoxybenzoic acid [4-[(2S)-2-methyloctoxy]phenyl] ester IUPAC Name: [4-[(2S)-2-methyloctoxy]phenyl] 4-decoxybenzoate Traditional Name: 4-decoxybenzoic acid [4-[(2S)-2-methyloctoxy]phenyl] ester Formula: C32H48O4 MolecularWeight: 496.72112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OCC(C)CCCCCC

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OC[C@@H](C)CCCCCC

InChI

InChI=1S/C32H48O4/c1-4-6-8-10-11-12-13-15-25-34-29-19-17-28(18-20-29)32(33)36-31-23-21-30(22-24-31)35-26-27(3)16-14-9-7-5-2/h17-24,27H,4-16,25-26H2,1-3H3/t27-/m0/s1