methyl (2S)-3-phenyl-2-[[5-(phenylsulfonylmethyl)furan-2-yl]carbonylamino]propanoate

Systemtic Name: methyl (2S)-3-phenyl-2-[[5-(phenylsulfonylmethyl)furan-2-yl]carbonylamino]propanoate Openeye Name: methyl (2S)-2-[[5-(benzenesulfonylmethyl)furan-2-carbonyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[[5-(benzenesulfonylmethyl)-2-furanyl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[5-(benzenesulfonylmethyl)furan-2-carbonyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[5-(besylmethyl)-2-furoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C22H21NO6S MolecularWeight: 427.47024

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC=C(O2)CS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C2=CC=C(O2)CS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H21NO6S/c1-28-22(25)19(14-16-8-4-2-5-9-16)23-21(24)20-13-12-17(29-20)15-30(26,27)18-10-6-3-7-11-18/h2-13,19H,14-15H2,1H3,(H,23,24)/t19-/m0/s1