2-[(4-ethylphenyl)methyl-[[(2R)-oxolan-2-yl]methyl]azaniumyl]ethanoate

Systemtic Name: 2-[(4-ethylphenyl)methyl-[[(2R)-oxolan-2-yl]methyl]azaniumyl]ethanoate Openeye Name: 2-[(4-ethylphenyl)methyl-[[(2R)-tetrahydrofuran-2-yl]methyl]ammonio]acetate CAS Name: 2-[(4-ethylphenyl)methyl-[[(2R)-2-oxolanyl]methyl]ammonio]acetate IUPAC Name: 2-[(4-ethylphenyl)methyl-[[(2R)-oxolan-2-yl]methyl]azaniumyl]acetate Traditional Name: 2-[(4-ethylbenzyl)-[[(2R)-tetrahydrofuran-2-yl]methyl]ammonio]acetate Formula: C16H23NO3 MolecularWeight: 277.35872

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+](CC2CCCO2)CC(=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+](C[C@H]2CCCO2)CC(=O)[O-]

InChI

InChI=1S/C16H23NO3/c1-2-13-5-7-14(8-6-13)10-17(12-16(18)19)11-15-4-3-9-20-15/h5-8,15H,2-4,9-12H2,1H3,(H,18,19)/t15-/m1/s1