[2-oxidanylidene-2-[[(2S)-oxolan-2-yl]methylamino]ethyl] 3,5-dimethylbenzoate

Systemtic Name: [2-oxidanylidene-2-[[(2S)-oxolan-2-yl]methylamino]ethyl] 3,5-dimethylbenzoate Openeye Name: [2-oxo-2-[[(2S)-tetrahydrofuran-2-yl]methylamino]ethyl] 3,5-dimethylbenzoate CAS Name: 3,5-dimethylbenzoic acid [2-oxo-2-[[(2S)-2-oxolanyl]methylamino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2S)-oxolan-2-yl]methylamino]ethyl] 3,5-dimethylbenzoate Traditional Name: 3,5-dimethylbenzoic acid [2-keto-2-[[(2S)-tetrahydrofuran-2-yl]methylamino]ethyl] ester Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)OCC(=O)NCC2CCCO2)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)OCC(=O)NC[C@@H]2CCCO2)C

InChI

InChI=1S/C16H21NO4/c1-11-6-12(2)8-13(7-11)16(19)21-10-15(18)17-9-14-4-3-5-20-14/h6-8,14H,3-5,9-10H2,1-2H3,(H,17,18)/t14-/m0/s1