2-[(5-carbamimidoyl-1-benzofuran-2-yl)carbonylamino]-2-phenylazanyl-ethanoic acid

Systemtic Name: 2-[(5-carbamimidoyl-1-benzofuran-2-yl)carbonylamino]-2-phenylazanyl-ethanoic acid Openeye Name: 2-anilino-2-[(5-carbamimidoylbenzofuran-2-carbonyl)amino]acetic acid CAS Name: 2-anilino-2-[[(5-carbamimidoyl-2-benzofuranyl)-oxomethyl]amino]acetic acid IUPAC Name: 2-anilino-2-[(5-carbamimidoyl-1-benzofuran-2-carbonyl)amino]acetic acid Traditional Name: 2-[(5-amidinobenzofuran-2-carbonyl)amino]-2-anilino-acetic acid Formula: C18H16N4O4 MolecularWeight: 352.34404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16N4O4/c19-15(20)10-6-7-13-11(8-10)9-14(26-13)17(23)22-16(18(24)25)21-12-4-2-1-3-5-12/h1-9,16,21H,(H3,19,20)(H,22,23)(H,24,25)