2-[4-[(5-carbamimidoyl-1-benzofuran-2-yl)carbonylamino]cyclohexyl]oxyethanoic acid

Systemtic Name: 2-[4-[(5-carbamimidoyl-1-benzofuran-2-yl)carbonylamino]cyclohexyl]oxyethanoic acid Openeye Name: 2-[4-[(5-carbamimidoylbenzofuran-2-carbonyl)amino]cyclohexoxy]acetic acid CAS Name: 2-[4-[[(5-carbamimidoyl-2-benzofuranyl)-oxomethyl]amino]cyclohexyl]oxyacetic acid IUPAC Name: 2-[4-[(5-carbamimidoyl-1-benzofuran-2-carbonyl)amino]cyclohexyl]oxyacetic acid Traditional Name: 2-[4-[(5-amidinobenzofuran-2-carbonyl)amino]cyclohexoxy]acetic acid Formula: C18H21N3O5 MolecularWeight: 359.37644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC(=O)C2=CC3=C(O2)C=CC(=C3)C(=N)N)OCC(=O)O

Isomeric SMILES

C1CC(CCC1NC(=O)C2=CC3=C(O2)C=CC(=C3)C(=N)N)OCC(=O)O

InChI

InChI=1S/C18H21N3O5/c19-17(20)10-1-6-14-11(7-10)8-15(26-14)18(24)21-12-2-4-13(5-3-12)25-9-16(22)23/h1,6-8,12-13H,2-5,9H2,(H3,19,20)(H,21,24)(H,22,23)