3-methyl-4-[(3,4,5-triethoxyphenyl)carbonylamino]benzoic acid

Systemtic Name: 3-methyl-4-[(3,4,5-triethoxyphenyl)carbonylamino]benzoic acid Openeye Name: 3-methyl-4-[(3,4,5-triethoxybenzoyl)amino]benzoic acid CAS Name: 3-methyl-4-[[oxo-(3,4,5-triethoxyphenyl)methyl]amino]benzoic acid IUPAC Name: 3-methyl-4-[(3,4,5-triethoxybenzoyl)amino]benzoic acid Traditional Name: 3-methyl-4-[(3,4,5-triethoxybenzoyl)amino]benzoic acid Formula: C21H25NO6 MolecularWeight: 387.4263

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=C(C=C(C=C2)C(=O)O)C

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=C(C=C(C=C2)C(=O)O)C

InChI

InChI=1S/C21H25NO6/c1-5-26-17-11-15(12-18(27-6-2)19(17)28-7-3)20(23)22-16-9-8-14(21(24)25)10-13(16)4/h8-12H,5-7H2,1-4H3,(H,22,23)(H,24,25)