3-(5-carbamimidoyl-7-methoxy-1-benzofuran-2-yl)-2-(4-pyrrolidin-3-yloxyphenyl)propanoic acid

Systemtic Name: 3-(5-carbamimidoyl-7-methoxy-1-benzofuran-2-yl)-2-(4-pyrrolidin-3-yloxyphenyl)propanoic acid Openeye Name: 3-(5-carbamimidoyl-7-methoxy-benzofuran-2-yl)-2-(4-pyrrolidin-3-yloxyphenyl)propanoic acid CAS Name: 3-(5-carbamimidoyl-7-methoxy-2-benzofuranyl)-2-[4-(3-pyrrolidinyloxy)phenyl]propanoic acid IUPAC Name: 3-(5-carbamimidoyl-7-methoxy-1-benzofuran-2-yl)-2-(4-pyrrolidin-3-yloxyphenyl)propanoic acid Traditional Name: 3-(5-amidino-7-methoxy-benzofuran-2-yl)-2-(4-pyrrolidin-3-yloxyphenyl)propionic acid Formula: C23H25N3O5 MolecularWeight: 423.4617

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1)C(=N)N)C=C(O2)CC(C3=CC=C(C=C3)OC4CCNC4)C(=O)O

Isomeric SMILES

COC1=C2C(=CC(=C1)C(=N)N)C=C(O2)CC(C3=CC=C(C=C3)OC4CCNC4)C(=O)O

InChI

InChI=1S/C23H25N3O5/c1-29-20-10-15(22(24)25)8-14-9-18(31-21(14)20)11-19(23(27)28)13-2-4-16(5-3-13)30-17-6-7-26-12-17/h2-5,8-10,17,19,26H,6-7,11-12H2,1H3,(H3,24,25)(H,27,28)