3-[2-[1-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]oxyphenyl]propanoic acid

Systemtic Name: 3-[2-[1-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]oxyphenyl]propanoic acid Openeye Name: 3-[2-[2-(4-chloro-2-methoxy-5-methyl-anilino)-1-methyl-2-oxo-ethoxy]phenyl]propanoic acid CAS Name: 3-[2-[1-(4-chloro-2-methoxy-5-methylanilino)-1-oxopropan-2-yl]oxyphenyl]propanoic acid IUPAC Name: 3-[2-[1-(4-chloro-2-methoxy-5-methylanilino)-1-oxopropan-2-yl]oxyphenyl]propanoic acid Traditional Name: 3-[2-[2-(4-chloro-2-methoxy-5-methyl-anilino)-2-keto-1-methyl-ethoxy]phenyl]propionic acid Formula: C20H22ClNO5 MolecularWeight: 391.84538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)C(C)OC2=CC=CC=C2CCC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)C(C)OC2=CC=CC=C2CCC(=O)O

InChI

InChI=1S/C20H22ClNO5/c1-12-10-16(18(26-3)11-15(12)21)22-20(25)13(2)27-17-7-5-4-6-14(17)8-9-19(23)24/h4-7,10-11,13H,8-9H2,1-3H3,(H,22,25)(H,23,24)