3-[4-[[4-[(2-phenoxypropylamino)methyl]phenyl]methoxy]phenyl]propanoic acid

Systemtic Name: 3-[4-[[4-[(2-phenoxypropylamino)methyl]phenyl]methoxy]phenyl]propanoic acid Openeye Name: 3-[4-[[4-[(2-phenoxypropylamino)methyl]phenyl]methoxy]phenyl]propanoic acid CAS Name: 3-[4-[[4-[(2-phenoxypropylamino)methyl]phenyl]methoxy]phenyl]propanoic acid IUPAC Name: 3-[4-[[4-[(2-phenoxypropylamino)methyl]phenyl]methoxy]phenyl]propanoic acid Traditional Name: 3-[4-[4-[(2-phenoxypropylamino)methyl]benzyl]oxyphenyl]propionic acid Formula: C26H29NO4 MolecularWeight: 419.51276

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNCC1=CC=C(C=C1)COC2=CC=C(C=C2)CCC(=O)O)OC3=CC=CC=C3

Isomeric SMILES

CC(CNCC1=CC=C(C=C1)COC2=CC=C(C=C2)CCC(=O)O)OC3=CC=CC=C3

InChI

InChI=1S/C26H29NO4/c1-20(31-25-5-3-2-4-6-25)17-27-18-22-7-9-23(10-8-22)19-30-24-14-11-21(12-15-24)13-16-26(28)29/h2-12,14-15,20,27H,13,16-19H2,1H3,(H,28,29)