5-[[4-[2-(2-chloranylphenoxy)propanoylamino]phenyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[[4-[2-(2-chloranylphenoxy)propanoylamino]phenyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[4-[2-(2-chlorophenoxy)propanoylamino]anilino]-5-oxo-pentanoic acid CAS Name: 5-[4-[[2-(2-chlorophenoxy)-1-oxopropyl]amino]anilino]-5-oxopentanoic acid IUPAC Name: 5-[4-[2-(2-chlorophenoxy)propanoylamino]anilino]-5-oxopentanoic acid Traditional Name: 5-[4-[2-(2-chlorophenoxy)propanoylamino]anilino]-5-keto-valeric acid Formula: C20H21ClN2O5 MolecularWeight: 404.84414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)NC(=O)CCCC(=O)O)OC2=CC=CC=C2Cl

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)NC(=O)CCCC(=O)O)OC2=CC=CC=C2Cl

InChI

InChI=1S/C20H21ClN2O5/c1-13(28-17-6-3-2-5-16(17)21)20(27)23-15-11-9-14(10-12-15)22-18(24)7-4-8-19(25)26/h2-3,5-6,9-13H,4,7-8H2,1H3,(H,22,24)(H,23,27)(H,25,26)