2-ethoxy-4-(3-phenylpropyl)-3-[(3,4,5-trimethoxyphenyl)carbonylamino]benzoic acid

Systemtic Name: 2-ethoxy-4-(3-phenylpropyl)-3-[(3,4,5-trimethoxyphenyl)carbonylamino]benzoic acid Openeye Name: 2-ethoxy-4-(3-phenylpropyl)-3-[(3,4,5-trimethoxybenzoyl)amino]benzoic acid CAS Name: 2-ethoxy-3-[[oxo-(3,4,5-trimethoxyphenyl)methyl]amino]-4-(3-phenylpropyl)benzoic acid IUPAC Name: 2-ethoxy-4-(3-phenylpropyl)-3-[(3,4,5-trimethoxybenzoyl)amino]benzoic acid Traditional Name: 2-ethoxy-4-(3-phenylpropyl)-3-[(3,4,5-trimethoxybenzoyl)amino]benzoic acid Formula: C28H31NO7 MolecularWeight: 493.54824

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1NC(=O)C2=CC(=C(C(=C2)OC)OC)OC)CCCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCOC1=C(C=CC(=C1NC(=O)C2=CC(=C(C(=C2)OC)OC)OC)CCCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C28H31NO7/c1-5-36-25-21(28(31)32)15-14-19(13-9-12-18-10-7-6-8-11-18)24(25)29-27(30)20-16-22(33-2)26(35-4)23(17-20)34-3/h6-8,10-11,14-17H,5,9,12-13H2,1-4H3,(H,29,30)(H,31,32)