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

Systemtic Name: 2-[(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)carbonylamino]terephthalic acid Openeye Name: 2-[(3-chloro-4-isopropoxy-5-methoxy-benzoyl)amino]terephthalic acid CAS Name: 2-[[(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)-oxomethyl]amino]terephthalic acid IUPAC Name: 2-[(3-chloro-5-methoxy-4-propan-2-yloxybenzoyl)amino]terephthalic acid Traditional Name: 2-[(3-chloro-4-isopropoxy-5-methoxy-benzoyl)amino]terephthalic acid Formula: C19H18ClNO7 MolecularWeight: 407.80172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1Cl)C(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1Cl)C(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O)OC

InChI

InChI=1S/C19H18ClNO7/c1-9(2)28-16-13(20)6-11(8-15(16)27-3)17(22)21-14-7-10(18(23)24)4-5-12(14)19(25)26/h4-9H,1-3H3,(H,21,22)(H,23,24)(H,25,26)