3-[3-[[(2,4-diethoxyphenyl)carbonylamino]methyl]-4-methoxy-phenyl]-2-propan-2-yloxy-propanoic acid

Systemtic Name: 3-[3-[[(2,4-diethoxyphenyl)carbonylamino]methyl]-4-methoxy-phenyl]-2-propan-2-yloxy-propanoic acid Openeye Name: 3-[3-[[(2,4-diethoxybenzoyl)amino]methyl]-4-methoxy-phenyl]-2-isopropoxy-propanoic acid CAS Name: 3-[3-[[[(2,4-diethoxyphenyl)-oxomethyl]amino]methyl]-4-methoxyphenyl]-2-propan-2-yloxypropanoic acid IUPAC Name: 3-[3-[[(2,4-diethoxybenzoyl)amino]methyl]-4-methoxyphenyl]-2-propan-2-yloxypropanoic acid Traditional Name: 3-[3-[[(2,4-diethoxybenzoyl)amino]methyl]-4-methoxy-phenyl]-2-isopropoxy-propionic acid Formula: C25H33NO7 MolecularWeight: 459.53202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)C(=O)NCC2=C(C=CC(=C2)CC(C(=O)O)OC(C)C)OC)OCC

Isomeric SMILES

CCOC1=CC(=C(C=C1)C(=O)NCC2=C(C=CC(=C2)CC(C(=O)O)OC(C)C)OC)OCC

InChI

InChI=1S/C25H33NO7/c1-6-31-19-9-10-20(22(14-19)32-7-2)24(27)26-15-18-12-17(8-11-21(18)30-5)13-23(25(28)29)33-16(3)4/h8-12,14,16,23H,6-7,13,15H2,1-5H3,(H,26,27)(H,28,29)