2-(butoxycarbonylamino)-3-[[4-(4-dibenzofuran-4-ylphenyl)phenyl]methoxy]propanoic acid

Systemtic Name: 2-(butoxycarbonylamino)-3-[[4-(4-dibenzofuran-4-ylphenyl)phenyl]methoxy]propanoic acid Openeye Name: 2-(butoxycarbonylamino)-3-[[4-(4-dibenzofuran-4-ylphenyl)phenyl]methoxy]propanoic acid CAS Name: 2-[[butoxy(oxo)methyl]amino]-3-[[4-[4-(4-dibenzofuranyl)phenyl]phenyl]methoxy]propanoic acid IUPAC Name: 2-(butoxycarbonylamino)-3-[[4-(4-dibenzofuran-4-ylphenyl)phenyl]methoxy]propanoic acid Traditional Name: 2-(butoxycarbonylamino)-3-[4-(4-dibenzofuran-4-ylphenyl)benzyl]oxy-propionic acid Formula: C33H31NO6 MolecularWeight: 537.60234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NC(COCC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=CC4=C3OC5=CC=CC=C45)C(=O)O

Isomeric SMILES

CCCCOC(=O)NC(COCC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=CC4=C3OC5=CC=CC=C45)C(=O)O

InChI

InChI=1S/C33H31NO6/c1-2-3-19-39-33(37)34-29(32(35)36)21-38-20-22-11-13-23(14-12-22)24-15-17-25(18-16-24)26-8-6-9-28-27-7-4-5-10-30(27)40-31(26)28/h4-18,29H,2-3,19-21H2,1H3,(H,34,37)(H,35,36)