[(E)-octadec-9-enyl] 4-(dimethylaminomethyl)benzoate

Systemtic Name: [(E)-octadec-9-enyl] 4-(dimethylaminomethyl)benzoate Openeye Name: [(E)-octadec-9-enyl] 4-(dimethylaminomethyl)benzoate CAS Name: 4-(dimethylaminomethyl)benzoic acid [(E)-octadec-9-enyl] ester IUPAC Name: [(E)-octadec-9-enyl] 4-(dimethylaminomethyl)benzoate Traditional Name: 4-(dimethylaminomethyl)benzoic acid [(E)-octadec-9-enyl] ester Formula: C28H47NO2 MolecularWeight: 429.67828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCOC(=O)C1=CC=C(C=C1)CN(C)C

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCOC(=O)C1=CC=C(C=C1)CN(C)C

InChI

InChI=1S/C28H47NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-31-28(30)27-22-20-26(21-23-27)25-29(2)3/h11-12,20-23H,4-10,13-19,24-25H2,1-3H3/b12-11+