2-[[3-chloranyl-5-methoxy-4-(2-methylpropoxy)phenyl]carbonylamino]terephthalic acid

Systemtic Name: 2-[[3-chloranyl-5-methoxy-4-(2-methylpropoxy)phenyl]carbonylamino]terephthalic acid Openeye Name: 2-[(3-chloro-4-isobutoxy-5-methoxy-benzoyl)amino]terephthalic acid CAS Name: 2-[[[3-chloro-5-methoxy-4-(2-methylpropoxy)phenyl]-oxomethyl]amino]terephthalic acid IUPAC Name: 2-[[3-chloro-5-methoxy-4-(2-methylpropoxy)benzoyl]amino]terephthalic acid Traditional Name: 2-[(3-chloro-4-isobutoxy-5-methoxy-benzoyl)amino]terephthalic acid Formula: C20H20ClNO7 MolecularWeight: 421.8283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1Cl)C(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O)OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1Cl)C(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O)OC

InChI

InChI=1S/C20H20ClNO7/c1-10(2)9-29-17-14(21)6-12(8-16(17)28-3)18(23)22-15-7-11(19(24)25)4-5-13(15)20(26)27/h4-8,10H,9H2,1-3H3,(H,22,23)(H,24,25)(H,26,27)