2-[3-[(6-chloranylnaphthalen-2-yl)sulfonyl-(furan-2-ylmethyl)amino]-2-oxidanylidene-pyrrolidin-1-yl]propanoic acid

Systemtic Name: 2-[3-[(6-chloranylnaphthalen-2-yl)sulfonyl-(furan-2-ylmethyl)amino]-2-oxidanylidene-pyrrolidin-1-yl]propanoic acid Openeye Name: 2-[3-[(6-chloro-2-naphthyl)sulfonyl-(2-furylmethyl)amino]-2-oxo-pyrrolidin-1-yl]propanoic acid CAS Name: 2-[3-[(6-chloro-2-naphthalenyl)sulfonyl-(2-furanylmethyl)amino]-2-oxo-1-pyrrolidinyl]propanoic acid IUPAC Name: 2-[3-[(6-chloronaphthalen-2-yl)sulfonyl-(furan-2-ylmethyl)amino]-2-oxopyrrolidin-1-yl]propanoic acid Traditional Name: 2-[3-[(6-chloro-2-naphthyl)sulfonyl-(2-furfuryl)amino]-2-keto-pyrrolidino]propionic acid Formula: C22H21ClN2O6S MolecularWeight: 476.92994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N1CCC(C1=O)N(CC2=CC=CO2)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl

Isomeric SMILES

CC(C(=O)O)N1CCC(C1=O)N(CC2=CC=CO2)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl

InChI

InChI=1S/C22H21ClN2O6S/c1-14(22(27)28)24-9-8-20(21(24)26)25(13-18-3-2-10-31-18)32(29,30)19-7-5-15-11-17(23)6-4-16(15)12-19/h2-7,10-12,14,20H,8-9,13H2,1H3,(H,27,28)