2-[2-[2-(5-carbamimidoyl-1-benzofuran-2-yl)ethyl]-5-pyrrolidin-3-yloxy-phenoxy]ethanoic acid

Systemtic Name: 2-[2-[2-(5-carbamimidoyl-1-benzofuran-2-yl)ethyl]-5-pyrrolidin-3-yloxy-phenoxy]ethanoic acid Openeye Name: 2-[2-[2-(5-carbamimidoylbenzofuran-2-yl)ethyl]-5-pyrrolidin-3-yloxy-phenoxy]acetic acid CAS Name: 2-[2-[2-(5-carbamimidoyl-2-benzofuranyl)ethyl]-5-(3-pyrrolidinyloxy)phenoxy]acetic acid IUPAC Name: 2-[2-[2-(5-carbamimidoyl-1-benzofuran-2-yl)ethyl]-5-pyrrolidin-3-yloxyphenoxy]acetic acid Traditional Name: 2-[2-[2-(5-amidinobenzofuran-2-yl)ethyl]-5-pyrrolidin-3-yloxy-phenoxy]acetic acid Formula: C23H25N3O5 MolecularWeight: 423.4617

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC1OC2=CC(=C(C=C2)CCC3=CC4=C(O3)C=CC(=C4)C(=N)N)OCC(=O)O

Isomeric SMILES

C1CNCC1OC2=CC(=C(C=C2)CCC3=CC4=C(O3)C=CC(=C4)C(=N)N)OCC(=O)O

InChI

InChI=1S/C23H25N3O5/c24-23(25)15-3-6-20-16(9-15)10-17(31-20)4-1-14-2-5-18(30-19-7-8-26-12-19)11-21(14)29-13-22(27)28/h2-3,5-6,9-11,19,26H,1,4,7-8,12-13H2,(H3,24,25)(H,27,28)