[1-(dimethylamino)-3-[(E)-octadec-9-enoxy]propan-2-yl] ethanoate hydrochloride

Systemtic Name: [1-(dimethylamino)-3-[(E)-octadec-9-enoxy]propan-2-yl] ethanoate hydrochloride Openeye Name: [1-(dimethylaminomethyl)-2-[(E)-octadec-9-enoxy]ethyl] acetate hydrochloride CAS Name: acetic acid [1-(dimethylamino)-3-[(E)-octadec-9-enoxy]propan-2-yl] ester hydrochloride IUPAC Name: [1-(dimethylamino)-3-[(E)-octadec-9-enoxy]propan-2-yl] acetate hydrochloride Traditional Name: acetic acid [1-(dimethylaminomethyl)-2-[(E)-octadec-9-enoxy]ethyl] ester hydrochloride Formula: C25H50ClNO3 MolecularWeight: 448.1224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCOCC(CN(C)C)OC(=O)C.Cl

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCOCC(CN(C)C)OC(=O)C.Cl

InChI

InChI=1S/C25H49NO3.ClH/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-28-23-25(22-26(3)4)29-24(2)27;/h12-13,25H,5-11,14-23H2,1-4H3;1H/b13-12+;