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

Systemtic Name: 2-[[(2R)-oxolan-2-yl]methyl-[(4-propan-2-ylphenyl)methyl]azaniumyl]ethanoate Openeye Name: 2-[(4-isopropylphenyl)methyl-[[(2R)-tetrahydrofuran-2-yl]methyl]ammonio]acetate CAS Name: 2-[[(2R)-2-oxolanyl]methyl-[(4-propan-2-ylphenyl)methyl]ammonio]acetate IUPAC Name: 2-[[(2R)-oxolan-2-yl]methyl-[(4-propan-2-ylphenyl)methyl]azaniumyl]acetate Traditional Name: 2-[(4-isopropylbenzyl)-[[(2R)-tetrahydrofuran-2-yl]methyl]ammonio]acetate Formula: C17H25NO3 MolecularWeight: 291.3853

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25NO3/c1-13(2)15-7-5-14(6-8-15)10-18(12-17(19)20)11-16-4-3-9-21-16/h5-8,13,16H,3-4,9-12H2,1-2H3,(H,19,20)/t16-/m1/s1