(2S)-2-azanyl-3-[3-[(2S)-1-[3,5-bis(chloranyl)phenyl]sulfonylpyrrolidin-2-yl]carbonyl-2-chloranyl-phenyl]propanoic acid

Systemtic Name: (2S)-2-azanyl-3-[3-[(2S)-1-[3,5-bis(chloranyl)phenyl]sulfonylpyrrolidin-2-yl]carbonyl-2-chloranyl-phenyl]propanoic acid Openeye Name: (2S)-2-amino-3-[2-chloro-3-[(2S)-1-(3,5-dichlorophenyl)sulfonylpyrrolidine-2-carbonyl]phenyl]propanoic acid CAS Name: (2S)-2-amino-3-[2-chloro-3-[[(2S)-1-(3,5-dichlorophenyl)sulfonyl-2-pyrrolidinyl]-oxomethyl]phenyl]propanoic acid IUPAC Name: (2S)-2-amino-3-[2-chloro-3-[(2S)-1-(3,5-dichlorophenyl)sulfonylpyrrolidine-2-carbonyl]phenyl]propanoic acid Traditional Name: (2S)-2-amino-3-[2-chloro-3-[(2S)-1-(3,5-dichlorophenyl)sulfonylprolyl]phenyl]propionic acid Formula: C20H19Cl3N2O5S MolecularWeight: 505.79926

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC(=CC(=C2)Cl)Cl)C(=O)C3=C(C(=CC=C3)CC(C(=O)O)N)Cl

Isomeric SMILES

C1C[C@H](N(C1)S(=O)(=O)C2=CC(=CC(=C2)Cl)Cl)C(=O)C3=C(C(=CC=C3)C[C@@H](C(=O)O)N)Cl

InChI

InChI=1S/C20H19Cl3N2O5S/c21-12-8-13(22)10-14(9-12)31(29,30)25-6-2-5-17(25)19(26)15-4-1-3-11(18(15)23)7-16(24)20(27)28/h1,3-4,8-10,16-17H,2,5-7,24H2,(H,27,28)/t16-,17-/m0/s1