2-azanyl-3-[(5-carbamimidoyl-1-benzofuran-2-yl)carbonylamino]-2-phenyl-propanoic acid

Systemtic Name: 2-azanyl-3-[(5-carbamimidoyl-1-benzofuran-2-yl)carbonylamino]-2-phenyl-propanoic acid Openeye Name: 2-amino-3-[(5-carbamimidoylbenzofuran-2-carbonyl)amino]-2-phenyl-propanoic acid CAS Name: 2-amino-3-[[(5-carbamimidoyl-2-benzofuranyl)-oxomethyl]amino]-2-phenylpropanoic acid IUPAC Name: 2-amino-3-[(5-carbamimidoyl-1-benzofuran-2-carbonyl)amino]-2-phenylpropanoic acid Traditional Name: 3-[(5-amidinobenzofuran-2-carbonyl)amino]-2-amino-2-phenyl-propionic acid Formula: C19H18N4O4 MolecularWeight: 366.37062

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CNC(=O)C2=CC3=C(O2)C=CC(=C3)C(=N)N)(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)C(CNC(=O)C2=CC3=C(O2)C=CC(=C3)C(=N)N)(C(=O)O)N

InChI

InChI=1S/C19H18N4O4/c20-16(21)11-6-7-14-12(8-11)9-15(27-14)17(24)23-10-19(22,18(25)26)13-4-2-1-3-5-13/h1-9H,10,22H2,(H3,20,21)(H,23,24)(H,25,26)