methyl (2S)-2-[(4-methylphenyl)sulfonylamino]-4-phenylselanyl-butanoate

Systemtic Name: methyl (2S)-2-[(4-methylphenyl)sulfonylamino]-4-phenylselanyl-butanoate Openeye Name: methyl (2S)-4-phenylselanyl-2-(p-tolylsulfonylamino)butanoate CAS Name: (2S)-2-[(4-methylphenyl)sulfonylamino]-4-(phenylseleno)butanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(4-methylphenyl)sulfonylamino]-4-phenylselanylbutanoate Traditional Name: (2S)-4-(phenylseleno)-2-(tosylamino)butyric acid methyl ester Formula: C18H21NO4SSe MolecularWeight: 426.38864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC[Se]C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CC[Se]C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C18H21NO4SSe/c1-14-8-10-15(11-9-14)24(21,22)19-17(18(20)23-2)12-13-25-16-6-4-3-5-7-16/h3-11,17,19H,12-13H2,1-2H3/t17-/m0/s1