2-[[1-(3-chlorophenyl)sulfonylpyrrolidin-2-yl]carbonylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[1-(3-chlorophenyl)sulfonylpyrrolidin-2-yl]carbonylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[1-(3-chlorophenyl)sulfonylpyrrolidine-2-carbonyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[[1-(3-chlorophenyl)sulfonyl-2-pyrrolidinyl]-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[1-(3-chlorophenyl)sulfonylpyrrolidine-2-carbonyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[1-(3-chlorophenyl)sulfonylprolyl]amino]-3-phenyl-propionic acid Formula: C20H21ClN2O5S MolecularWeight: 436.90914

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC(=CC=C2)Cl)C(=O)NC(CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC(=CC=C2)Cl)C(=O)NC(CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C20H21ClN2O5S/c21-15-8-4-9-16(13-15)29(27,28)23-11-5-10-18(23)19(24)22-17(20(25)26)12-14-6-2-1-3-7-14/h1-4,6-9,13,17-18H,5,10-12H2,(H,22,24)(H,25,26)