tert-butyl 2-[3-[(6-chloranylnaphthalen-2-yl)sulfonyl-methyl-amino]-2-oxidanylidene-pyrrolidin-1-yl]propanoate

Systemtic Name: tert-butyl 2-[3-[(6-chloranylnaphthalen-2-yl)sulfonyl-methyl-amino]-2-oxidanylidene-pyrrolidin-1-yl]propanoate Openeye Name: tert-butyl 2-[3-[(6-chloro-2-naphthyl)sulfonyl-methyl-amino]-2-oxo-pyrrolidin-1-yl]propanoate CAS Name: 2-[3-[(6-chloro-2-naphthalenyl)sulfonyl-methylamino]-2-oxo-1-pyrrolidinyl]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[3-[(6-chloronaphthalen-2-yl)sulfonyl-methylamino]-2-oxopyrrolidin-1-yl]propanoate Traditional Name: 2-[3-[(6-chloro-2-naphthyl)sulfonyl-methyl-amino]-2-keto-pyrrolidino]propionic acid tert-butyl ester Formula: C22H27ClN2O5S MolecularWeight: 466.97818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC(C)(C)C)N1CCC(C1=O)N(C)S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl

Isomeric SMILES

CC(C(=O)OC(C)(C)C)N1CCC(C1=O)N(C)S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl

InChI

InChI=1S/C22H27ClN2O5S/c1-14(21(27)30-22(2,3)4)25-11-10-19(20(25)26)24(5)31(28,29)18-9-7-15-12-17(23)8-6-16(15)13-18/h6-9,12-14,19H,10-11H2,1-5H3