propan-2-yl 3-(3-chloranyl-4-oxidanyl-phenyl)-2-[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonylamino]propanoate

Systemtic Name: propan-2-yl 3-(3-chloranyl-4-oxidanyl-phenyl)-2-[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonylamino]propanoate Openeye Name: isopropyl 3-(3-chloro-4-hydroxy-phenyl)-2-[[1-(p-tolylsulfonyl)pyrrolidine-2-carbonyl]amino]propanoate CAS Name: 3-(3-chloro-4-hydroxyphenyl)-2-[[[1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]-oxomethyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(3-chloro-4-hydroxyphenyl)-2-[[1-(4-methylphenyl)sulfonylpyrrolidine-2-carbonyl]amino]propanoate Traditional Name: 3-(3-chloro-4-hydroxy-phenyl)-2-[(1-tosylprolyl)amino]propionic acid isopropyl ester Formula: C24H29ClN2O6S MolecularWeight: 509.01486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC(CC3=CC(=C(C=C3)O)Cl)C(=O)OC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC(CC3=CC(=C(C=C3)O)Cl)C(=O)OC(C)C

InChI

InChI=1S/C24H29ClN2O6S/c1-15(2)33-24(30)20(14-17-8-11-22(28)19(25)13-17)26-23(29)21-5-4-12-27(21)34(31,32)18-9-6-16(3)7-10-18/h6-11,13,15,20-21,28H,4-5,12,14H2,1-3H3,(H,26,29)