[[(1S)-1-phenylethyl]-[2-(phenylsulfonyl)ethyl]amino] 2,2-dimethylpropanoate

Systemtic Name: [[(1S)-1-phenylethyl]-[2-(phenylsulfonyl)ethyl]amino] 2,2-dimethylpropanoate Openeye Name: [2-(benzenesulfonyl)ethyl-[(1S)-1-phenylethyl]amino] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [2-(benzenesulfonyl)ethyl-[(1S)-1-phenylethyl]amino] ester IUPAC Name: [2-(benzenesulfonyl)ethyl-[(1S)-1-phenylethyl]amino] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [2-besylethyl-[(1S)-1-phenylethyl]amino] ester Formula: C21H27NO4S MolecularWeight: 389.50838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(CCS(=O)(=O)C2=CC=CC=C2)OC(=O)C(C)(C)C

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)N(CCS(=O)(=O)C2=CC=CC=C2)OC(=O)C(C)(C)C

InChI

InChI=1S/C21H27NO4S/c1-17(18-11-7-5-8-12-18)22(26-20(23)21(2,3)4)15-16-27(24,25)19-13-9-6-10-14-19/h5-14,17H,15-16H2,1-4H3/t17-/m0/s1