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

Systemtic Name: 2-[[3-carbamimidoyl-5-(phenylmethyl)-1-benzofuran-2-yl]carbonylamino]-2-phenoxy-ethanoic acid Openeye Name: 2-[(5-benzyl-3-carbamimidoyl-benzofuran-2-carbonyl)amino]-2-phenoxy-acetic acid CAS Name: 2-[[[3-carbamimidoyl-5-(phenylmethyl)-2-benzofuranyl]-oxomethyl]amino]-2-phenoxyacetic acid IUPAC Name: 2-[(5-benzyl-3-carbamimidoyl-1-benzofuran-2-carbonyl)amino]-2-phenoxyacetic acid Traditional Name: 2-[(3-amidino-5-benzyl-benzofuran-2-carbonyl)amino]-2-phenoxy-acetic acid Formula: C25H21N3O5 MolecularWeight: 443.45134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC3=C(C=C2)OC(=C3C(=N)N)C(=O)NC(C(=O)O)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC3=C(C=C2)OC(=C3C(=N)N)C(=O)NC(C(=O)O)OC4=CC=CC=C4

InChI

InChI=1S/C25H21N3O5/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/h1-12,14,24H,13H2,(H3,26,27)(H,28,29)(H,30,31)