methyl (2S)-3-(4-cyanophenyl)-2-(naphthalen-2-ylsulfonylamino)propanoate

Systemtic Name: methyl (2S)-3-(4-cyanophenyl)-2-(naphthalen-2-ylsulfonylamino)propanoate Openeye Name: methyl (2S)-3-(4-cyanophenyl)-2-(2-naphthylsulfonylamino)propanoate CAS Name: (2S)-3-(4-cyanophenyl)-2-(2-naphthalenylsulfonylamino)propanoic acid methyl ester IUPAC Name: methyl (2S)-3-(4-cyanophenyl)-2-(naphthalen-2-ylsulfonylamino)propanoate Traditional Name: (2S)-3-(4-cyanophenyl)-2-(2-naphthylsulfonylamino)propionic acid methyl ester Formula: C21H18N2O4S MolecularWeight: 394.44362

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)C#N)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

COC(=O)[C@H](CC1=CC=C(C=C1)C#N)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H18N2O4S/c1-27-21(24)20(12-15-6-8-16(14-22)9-7-15)23-28(25,26)19-11-10-17-4-2-3-5-18(17)13-19/h2-11,13,20,23H,12H2,1H3/t20-/m0/s1