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

Systemtic Name: 3-[2-[[(2-chloranyl-4-ethoxy-phenyl)carbonylamino]methyl]-4-methoxy-phenyl]-3-propan-2-yloxy-propanoic acid Openeye Name: 3-[2-[[(2-chloro-4-ethoxy-benzoyl)amino]methyl]-4-methoxy-phenyl]-3-isopropoxy-propanoic acid CAS Name: 3-[2-[[[(2-chloro-4-ethoxyphenyl)-oxomethyl]amino]methyl]-4-methoxyphenyl]-3-propan-2-yloxypropanoic acid IUPAC Name: 3-[2-[[(2-chloro-4-ethoxybenzoyl)amino]methyl]-4-methoxyphenyl]-3-propan-2-yloxypropanoic acid Traditional Name: 3-[2-[[(2-chloro-4-ethoxy-benzoyl)amino]methyl]-4-methoxy-phenyl]-3-isopropoxy-propionic acid Formula: C23H28ClNO6 MolecularWeight: 449.92452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28ClNO6/c1-5-30-17-7-9-19(20(24)11-17)23(28)25-13-15-10-16(29-4)6-8-18(15)21(12-22(26)27)31-14(2)3/h6-11,14,21H,5,12-13H2,1-4H3,(H,25,28)(H,26,27)