[4-(dimethylaminomethyl)phenyl]methyl (Z)-octadec-9-enoate

Systemtic Name: [4-(dimethylaminomethyl)phenyl]methyl (Z)-octadec-9-enoate Openeye Name: [4-(dimethylaminomethyl)phenyl]methyl (Z)-octadec-9-enoate CAS Name: (Z)-9-octadecenoic acid [4-(dimethylaminomethyl)phenyl]methyl ester IUPAC Name: [4-(dimethylaminomethyl)phenyl]methyl (Z)-octadec-9-enoate Traditional Name: (Z)-octadec-9-enoic acid [4-(dimethylaminomethyl)benzyl] ester Formula: C28H47NO2 MolecularWeight: 429.67828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OCC1=CC=C(C=C1)CN(C)C

Isomeric SMILES

CCCCCCCC/C=C\CCCCCCCC(=O)OCC1=CC=C(C=C1)CN(C)C

InChI

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