3-[1-[(5-carbamimidoyl-1-benzofuran-2-yl)carbonyl]piperidin-4-yl]propanoic acid

Systemtic Name: 3-[1-[(5-carbamimidoyl-1-benzofuran-2-yl)carbonyl]piperidin-4-yl]propanoic acid Openeye Name: 3-[1-(5-carbamimidoylbenzofuran-2-carbonyl)-4-piperidyl]propanoic acid CAS Name: 3-[1-[(5-carbamimidoyl-2-benzofuranyl)-oxomethyl]-4-piperidinyl]propanoic acid IUPAC Name: 3-[1-(5-carbamimidoyl-1-benzofuran-2-carbonyl)piperidin-4-yl]propanoic acid Traditional Name: 3-[1-(5-amidinobenzofuran-2-carbonyl)-4-piperidyl]propionic acid Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCC(=O)O)C(=O)C2=CC3=C(O2)C=CC(=C3)C(=N)N

Isomeric SMILES

C1CN(CCC1CCC(=O)O)C(=O)C2=CC3=C(O2)C=CC(=C3)C(=N)N

InChI

InChI=1S/C18H21N3O4/c19-17(20)12-2-3-14-13(9-12)10-15(25-14)18(24)21-7-5-11(6-8-21)1-4-16(22)23/h2-3,9-11H,1,4-8H2,(H3,19,20)(H,22,23)