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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O6S/c1-15-10-12-17(13-11-15)31(28,29)24-14-6-9-18(24)21(26)23-19(22(27)30-2)20(25)16-7-4-3-5-8-16/h3-5,7-8,10-13,18-20,25H,6,9,14H2,1-2H3,(H,23,26)