2-[(3-methoxy-4-propoxy-phenyl)carbonylamino]terephthalic acid

Systemtic Name: 2-[(3-methoxy-4-propoxy-phenyl)carbonylamino]terephthalic acid Openeye Name: 2-[(3-methoxy-4-propoxy-benzoyl)amino]terephthalic acid CAS Name: 2-[[(3-methoxy-4-propoxyphenyl)-oxomethyl]amino]terephthalic acid IUPAC Name: 2-[(3-methoxy-4-propoxybenzoyl)amino]terephthalic acid Traditional Name: 2-[(3-methoxy-4-propoxy-benzoyl)amino]terephthalic acid Formula: C19H19NO7 MolecularWeight: 373.35666

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O)OC

InChI

InChI=1S/C19H19NO7/c1-3-8-27-15-7-5-11(10-16(15)26-2)17(21)20-14-9-12(18(22)23)4-6-13(14)19(24)25/h4-7,9-10H,3,8H2,1-2H3,(H,20,21)(H,22,23)(H,24,25)