[[3-carbamimidoyl-5-(phenylmethyl)-1-benzofuran-2-yl]carbonylamino] 2-phenoxyethanoate

Systemtic Name: [[3-carbamimidoyl-5-(phenylmethyl)-1-benzofuran-2-yl]carbonylamino] 2-phenoxyethanoate Openeye Name: [(5-benzyl-3-carbamimidoyl-benzofuran-2-carbonyl)amino] 2-phenoxyacetate CAS Name: 2-phenoxyacetic acid [[[3-carbamimidoyl-5-(phenylmethyl)-2-benzofuranyl]-oxomethyl]amino] ester IUPAC Name: [(5-benzyl-3-carbamimidoyl-1-benzofuran-2-carbonyl)amino] 2-phenoxyacetate Traditional Name: 2-phenoxyacetic acid [(3-amidino-5-benzyl-benzofuran-2-carbonyl)amino] ester 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)NOC(=O)COC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC3=C(C=C2)OC(=C3C(=N)N)C(=O)NOC(=O)COC4=CC=CC=C4

InChI

InChI=1S/C25H21N3O5/c26-24(27)22-19-14-17(13-16-7-3-1-4-8-16)11-12-20(19)32-23(22)25(30)28-33-21(29)15-31-18-9-5-2-6-10-18/h1-12,14H,13,15H2,(H3,26,27)(H,28,30)