methyl (2S)-2-[(4-methylsulfonylphenyl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[(4-methylsulfonylphenyl)carbonylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[(4-methylsulfonylbenzoyl)amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(4-methylsulfonylphenyl)-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(4-methylsulfonylbenzoyl)amino]-3-phenylpropanoate Traditional Name: (2S)-2-[(4-mesylbenzoyl)amino]-3-phenyl-propionic acid methyl ester Formula: C18H19NO5S MolecularWeight: 361.41216

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C18H19NO5S/c1-24-18(21)16(12-13-6-4-3-5-7-13)19-17(20)14-8-10-15(11-9-14)25(2,22)23/h3-11,16H,12H2,1-2H3,(H,19,20)/t16-/m0/s1