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

Systemtic Name: 2-[[4-[(5-carbamimidoyl-1-benzofuran-2-yl)carbonylamino]cyclohexyl]amino]ethanoic acid Openeye Name: 2-[[4-[(5-carbamimidoylbenzofuran-2-carbonyl)amino]cyclohexyl]amino]acetic acid CAS Name: 2-[[4-[[(5-carbamimidoyl-2-benzofuranyl)-oxomethyl]amino]cyclohexyl]amino]acetic acid IUPAC Name: 2-[[4-[(5-carbamimidoyl-1-benzofuran-2-carbonyl)amino]cyclohexyl]amino]acetic acid Traditional Name: 2-[[4-[(5-amidinobenzofuran-2-carbonyl)amino]cyclohexyl]amino]acetic acid Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NCC(=O)O)NC(=O)C2=CC3=C(O2)C=CC(=C3)C(=N)N

Isomeric SMILES

C1CC(CCC1NCC(=O)O)NC(=O)C2=CC3=C(O2)C=CC(=C3)C(=N)N

InChI

InChI=1S/C18H22N4O4/c19-17(20)10-1-6-14-11(7-10)8-15(26-14)18(25)22-13-4-2-12(3-5-13)21-9-16(23)24/h1,6-8,12-13,21H,2-5,9H2,(H3,19,20)(H,22,25)(H,23,24)