methyl 3-(4-hydroxyphenyl)-2-[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonylamino]propanoate

Systemtic Name: methyl 3-(4-hydroxyphenyl)-2-[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonylamino]propanoate Openeye Name: methyl 3-(4-hydroxyphenyl)-2-[[1-(p-tolylsulfonyl)pyrrolidine-2-carbonyl]amino]propanoate CAS Name: 3-(4-hydroxyphenyl)-2-[[[1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(4-hydroxyphenyl)-2-[[1-(4-methylphenyl)sulfonylpyrrolidine-2-carbonyl]amino]propanoate Traditional Name: 3-(4-hydroxyphenyl)-2-[(1-tosylprolyl)amino]propionic acid methyl ester Formula: C22H26N2O6S MolecularWeight: 446.51664

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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)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O6S/c1-15-5-11-18(12-6-15)31(28,29)24-13-3-4-20(24)21(26)23-19(22(27)30-2)14-16-7-9-17(25)10-8-16/h5-12,19-20,25H,3-4,13-14H2,1-2H3,(H,23,26)