2-[[2-[3-[3-[(4-chlorophenyl)amino]pyrrolidin-1-yl]-2-oxidanyl-propoxy]phenyl]amino]-2-oxidanylidene-ethanoate

Systemtic Name: 2-[[2-[3-[3-[(4-chlorophenyl)amino]pyrrolidin-1-yl]-2-oxidanyl-propoxy]phenyl]amino]-2-oxidanylidene-ethanoate Openeye Name: 2-[2-[3-[3-(4-chloroanilino)pyrrolidin-1-yl]-2-hydroxy-propoxy]anilino]-2-oxo-acetate CAS Name: 2-[2-[3-[3-(4-chloroanilino)-1-pyrrolidinyl]-2-hydroxypropoxy]anilino]-2-oxoacetate IUPAC Name: 2-[2-[3-[3-(4-chloroanilino)pyrrolidin-1-yl]-2-hydroxypropoxy]anilino]-2-oxoacetate Traditional Name: 2-[2-[3-[3-(4-chloroanilino)pyrrolidino]-2-hydroxy-propoxy]anilino]-2-keto-acetate Formula: C21H23ClN3O5- MolecularWeight: 432.87742

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1NC2=CC=C(C=C2)Cl)CC(COC3=CC=CC=C3NC(=O)C(=O)[O-])O

Isomeric SMILES

C1CN(CC1NC2=CC=C(C=C2)Cl)CC(COC3=CC=CC=C3NC(=O)C(=O)[O-])O

InChI

InChI=1S/C21H24ClN3O5/c22-14-5-7-15(8-6-14)23-16-9-10-25(11-16)12-17(26)13-30-19-4-2-1-3-18(19)24-20(27)21(28)29/h1-8,16-17,23,26H,9-13H2,(H,24,27)(H,28,29)/p-1