5-[[(2R)-2-(4-chloranyl-2-methyl-phenoxy)propanoyl]amino]benzene-1,3-dicarboxylate

Systemtic Name: 5-[[(2R)-2-(4-chloranyl-2-methyl-phenoxy)propanoyl]amino]benzene-1,3-dicarboxylate Openeye Name: 5-[[(2R)-2-(4-chloro-2-methyl-phenoxy)propanoyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[(2R)-2-(4-chloro-2-methylphenoxy)-1-oxopropyl]amino]benzene-1,3-dicarboxylate IUPAC Name: 5-[[(2R)-2-(4-chloro-2-methylphenoxy)propanoyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[(2R)-2-(4-chloro-2-methyl-phenoxy)propanoyl]amino]isophthalate Formula: C18H14ClNO6-2 MolecularWeight: 375.75986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OC(C)C(=O)NC2=CC(=CC(=C2)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)O[C@H](C)C(=O)NC2=CC(=CC(=C2)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C18H16ClNO6/c1-9-5-13(19)3-4-15(9)26-10(2)16(21)20-14-7-11(17(22)23)6-12(8-14)18(24)25/h3-8,10H,1-2H3,(H,20,21)(H,22,23)(H,24,25)/p-2/t10-/m1/s1