ethyl (2S)-3-(3,4-dihydronaphthalen-1-yl)-2-[(4-methylphenyl)sulfonylamino]propanoate

Systemtic Name: ethyl (2S)-3-(3,4-dihydronaphthalen-1-yl)-2-[(4-methylphenyl)sulfonylamino]propanoate Openeye Name: ethyl (2S)-3-(3,4-dihydronaphthalen-1-yl)-2-(p-tolylsulfonylamino)propanoate CAS Name: (2S)-3-(3,4-dihydronaphthalen-1-yl)-2-[(4-methylphenyl)sulfonylamino]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-3-(3,4-dihydronaphthalen-1-yl)-2-[(4-methylphenyl)sulfonylamino]propanoate Traditional Name: (2S)-3-(3,4-dihydronaphthalen-1-yl)-2-(tosylamino)propionic acid ethyl ester Formula: C22H25NO4S MolecularWeight: 399.5032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CCCC2=CC=CC=C21)NS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)[C@H](CC1=CCCC2=CC=CC=C21)NS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H25NO4S/c1-3-27-22(24)21(23-28(25,26)19-13-11-16(2)12-14-19)15-18-9-6-8-17-7-4-5-10-20(17)18/h4-5,7,9-14,21,23H,3,6,8,15H2,1-2H3/t21-/m0/s1