ethyl 3-(1-methyl-3,3-dipentyl-azetidin-1-ium-1-yl)propanoate

Systemtic Name: ethyl 3-(1-methyl-3,3-dipentyl-azetidin-1-ium-1-yl)propanoate Openeye Name: ethyl 3-(1-methyl-3,3-dipentyl-azetidin-1-ium-1-yl)propanoate CAS Name: 3-(1-methyl-3,3-dipentyl-1-azetidin-1-iumyl)propanoic acid ethyl ester IUPAC Name: ethyl 3-(1-methyl-3,3-dipentylazetidin-1-ium-1-yl)propanoate Traditional Name: 3-(3,3-diamyl-1-methyl-azetidin-1-ium-1-yl)propionic acid ethyl ester Formula: C19H38NO2+ MolecularWeight: 312.51052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(C[N+](C1)(C)CCC(=O)OCC)CCCCC

Isomeric SMILES

CCCCCC1(C[N+](C1)(C)CCC(=O)OCC)CCCCC

InChI

InChI=1S/C19H38NO2/c1-5-8-10-13-19(14-11-9-6-2)16-20(4,17-19)15-12-18(21)22-7-3/h5-17H2,1-4H3/q+1