[4-[(dioctylamino)methyl]-2-ethanoyl-phenyl] ethanoate

Systemtic Name: [4-[(dioctylamino)methyl]-2-ethanoyl-phenyl] ethanoate Openeye Name: [2-acetyl-4-[(dioctylamino)methyl]phenyl] acetate CAS Name: acetic acid [2-acetyl-4-[(dioctylamino)methyl]phenyl] ester IUPAC Name: [2-acetyl-4-[(dioctylamino)methyl]phenyl] acetate Traditional Name: acetic acid [2-acetyl-4-[(dioctylamino)methyl]phenyl] ester Formula: C27H45NO3 MolecularWeight: 431.6511

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(CCCCCCCC)CC1=CC(=C(C=C1)OC(=O)C)C(=O)C

Isomeric SMILES

CCCCCCCCN(CCCCCCCC)CC1=CC(=C(C=C1)OC(=O)C)C(=O)C

InChI

InChI=1S/C27H45NO3/c1-5-7-9-11-13-15-19-28(20-16-14-12-10-8-6-2)22-25-17-18-27(31-24(4)30)26(21-25)23(3)29/h17-18,21H,5-16,19-20,22H2,1-4H3