2-[[3-carbamimidoyl-5-(phenylmethyl)-1-benzofuran-2-yl]carbonylamino]-2-cyclohexyloxy-ethanoic acid

Systemtic Name: 2-[[3-carbamimidoyl-5-(phenylmethyl)-1-benzofuran-2-yl]carbonylamino]-2-cyclohexyloxy-ethanoic acid Openeye Name: 2-[(5-benzyl-3-carbamimidoyl-benzofuran-2-carbonyl)amino]-2-(cyclohexoxy)acetic acid CAS Name: 2-[[[3-carbamimidoyl-5-(phenylmethyl)-2-benzofuranyl]-oxomethyl]amino]-2-cyclohexyloxyacetic acid IUPAC Name: 2-[(5-benzyl-3-carbamimidoyl-1-benzofuran-2-carbonyl)amino]-2-cyclohexyloxyacetic acid Traditional Name: 2-[(3-amidino-5-benzyl-benzofuran-2-carbonyl)amino]-2-(cyclohexoxy)acetic acid Formula: C25H27N3O5 MolecularWeight: 449.49898

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(C(=O)O)NC(=O)C2=C(C3=C(O2)C=CC(=C3)CC4=CC=CC=C4)C(=N)N

Isomeric SMILES

C1CCC(CC1)OC(C(=O)O)NC(=O)C2=C(C3=C(O2)C=CC(=C3)CC4=CC=CC=C4)C(=N)N

InChI

InChI=1S/C25H27N3O5/c26-22(27)20-18-14-16(13-15-7-3-1-4-8-15)11-12-19(18)33-21(20)23(29)28-24(25(30)31)32-17-9-5-2-6-10-17/h1,3-4,7-8,11-12,14,17,24H,2,5-6,9-10,13H2,(H3,26,27)(H,28,29)(H,30,31)