2-[[4-[(5-carbamimidoyl-1-benzofuran-2-yl)carbonylamino]cyclohexyl]-(carboxymethyl)amino]ethanoic acid

Systemtic Name: 2-[[4-[(5-carbamimidoyl-1-benzofuran-2-yl)carbonylamino]cyclohexyl]-(carboxymethyl)amino]ethanoic acid Openeye Name: 2-[[4-[(5-carbamimidoylbenzofuran-2-carbonyl)amino]cyclohexyl]-(carboxymethyl)amino]acetic acid CAS Name: 2-[[4-[[(5-carbamimidoyl-2-benzofuranyl)-oxomethyl]amino]cyclohexyl]-(carboxymethyl)amino]acetic acid IUPAC Name: 2-[[4-[(5-carbamimidoyl-1-benzofuran-2-carbonyl)amino]cyclohexyl]-(carboxymethyl)amino]acetic acid Traditional Name: 2-[[4-[(5-amidinobenzofuran-2-carbonyl)amino]cyclohexyl]-(carboxymethyl)amino]acetic acid Formula: C20H24N4O6 MolecularWeight: 416.42776

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N4O6/c21-19(22)11-1-6-15-12(7-11)8-16(30-15)20(29)23-13-2-4-14(5-3-13)24(9-17(25)26)10-18(27)28/h1,6-8,13-14H,2-5,9-10H2,(H3,21,22)(H,23,29)(H,25,26)(H,27,28)