2-[4-[(5-carbamimidoyl-3-methyl-1-benzofuran-2-yl)carbonylamino]cyclohexyl]oxyethanoic acid

Systemtic Name: 2-[4-[(5-carbamimidoyl-3-methyl-1-benzofuran-2-yl)carbonylamino]cyclohexyl]oxyethanoic acid Openeye Name: 2-[4-[(5-carbamimidoyl-3-methyl-benzofuran-2-carbonyl)amino]cyclohexoxy]acetic acid CAS Name: 2-[4-[[(5-carbamimidoyl-3-methyl-2-benzofuranyl)-oxomethyl]amino]cyclohexyl]oxyacetic acid IUPAC Name: 2-[4-[(5-carbamimidoyl-3-methyl-1-benzofuran-2-carbonyl)amino]cyclohexyl]oxyacetic acid Traditional Name: 2-[4-[(5-amidino-3-methyl-benzofuran-2-carbonyl)amino]cyclohexoxy]acetic acid Formula: C19H23N3O5 MolecularWeight: 373.40302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)C(=N)N)C(=O)NC3CCC(CC3)OCC(=O)O

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)C(=N)N)C(=O)NC3CCC(CC3)OCC(=O)O

InChI

InChI=1S/C19H23N3O5/c1-10-14-8-11(18(20)21)2-7-15(14)27-17(10)19(25)22-12-3-5-13(6-4-12)26-9-16(23)24/h2,7-8,12-13H,3-6,9H2,1H3,(H3,20,21)(H,22,25)(H,23,24)