2-[4-[(5-carbamimidoylfuro[2,3-b]pyridin-2-yl)carbonylamino]cyclohexyl]propanoic acid

Systemtic Name: 2-[4-[(5-carbamimidoylfuro[2,3-b]pyridin-2-yl)carbonylamino]cyclohexyl]propanoic acid Openeye Name: 2-[4-[(5-carbamimidoylfuro[2,3-b]pyridine-2-carbonyl)amino]cyclohexyl]propanoic acid CAS Name: 2-[4-[[(5-carbamimidoyl-2-furo[2,3-b]pyridinyl)-oxomethyl]amino]cyclohexyl]propanoic acid IUPAC Name: 2-[4-[(5-carbamimidoylfuro[2,3-b]pyridine-2-carbonyl)amino]cyclohexyl]propanoic acid Traditional Name: 2-[4-[(5-amidinofuro[2,3-b]pyridine-2-carbonyl)amino]cyclohexyl]propionic acid Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCC(CC1)NC(=O)C2=CC3=CC(=CN=C3O2)C(=N)N)C(=O)O

Isomeric SMILES

CC(C1CCC(CC1)NC(=O)C2=CC3=CC(=CN=C3O2)C(=N)N)C(=O)O

InChI

InChI=1S/C18H22N4O4/c1-9(18(24)25)10-2-4-13(5-3-10)22-16(23)14-7-11-6-12(15(19)20)8-21-17(11)26-14/h6-10,13H,2-5H2,1H3,(H3,19,20)(H,22,23)(H,24,25)