2-[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonyl-4-(prop-2-enoxycarbonylamino)butanoic acid

Systemtic Name: 2-[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonyl-4-(prop-2-enoxycarbonylamino)butanoic acid Openeye Name: 4-(allyloxycarbonylamino)-2-[1-(p-tolylsulfonyl)pyrrolidine-2-carbonyl]butanoic acid CAS Name: 2-[[1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]-oxomethyl]-4-[[oxo(prop-2-enoxy)methyl]amino]butanoic acid IUPAC Name: 2-[1-(4-methylphenyl)sulfonylpyrrolidine-2-carbonyl]-4-(prop-2-enoxycarbonylamino)butanoic acid Traditional Name: 4-(allyloxycarbonylamino)-2-(1-tosylprolyl)butyric acid Formula: C20H26N2O7S MolecularWeight: 438.49464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)C(CCNC(=O)OCC=C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)C(CCNC(=O)OCC=C)C(=O)O

InChI

InChI=1S/C20H26N2O7S/c1-3-13-29-20(26)21-11-10-16(19(24)25)18(23)17-5-4-12-22(17)30(27,28)15-8-6-14(2)7-9-15/h3,6-9,16-17H,1,4-5,10-13H2,2H3,(H,21,26)(H,24,25)