[2-oxidanylidene-2-[[(2S)-2-phenylpropyl]amino]ethyl] 2-ethylsulfonylbenzoate

Systemtic Name: [2-oxidanylidene-2-[[(2S)-2-phenylpropyl]amino]ethyl] 2-ethylsulfonylbenzoate Openeye Name: [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] 2-ethylsulfonylbenzoate CAS Name: 2-ethylsulfonylbenzoic acid [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] 2-ethylsulfonylbenzoate Traditional Name: 2-esylbenzoic acid [2-keto-2-[[(2S)-2-phenylpropyl]amino]ethyl] ester Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=CC=C1C(=O)OCC(=O)NCC(C)C2=CC=CC=C2

Isomeric SMILES

CCS(=O)(=O)C1=CC=CC=C1C(=O)OCC(=O)NC[C@@H](C)C2=CC=CC=C2

InChI

InChI=1S/C20H23NO5S/c1-3-27(24,25)18-12-8-7-11-17(18)20(23)26-14-19(22)21-13-15(2)16-9-5-4-6-10-16/h4-12,15H,3,13-14H2,1-2H3,(H,21,22)/t15-/m1/s1