2-[[4-[(5-carbamimidoyl-1-benzofuran-2-yl)carbonylamino]phenyl]-pentanoyl-amino]ethanoic acid

Systemtic Name: 2-[[4-[(5-carbamimidoyl-1-benzofuran-2-yl)carbonylamino]phenyl]-pentanoyl-amino]ethanoic acid Openeye Name: 2-[4-[(5-carbamimidoylbenzofuran-2-carbonyl)amino]-N-pentanoyl-anilino]acetic acid CAS Name: 2-[4-[[(5-carbamimidoyl-2-benzofuranyl)-oxomethyl]amino]-N-(1-oxopentyl)anilino]acetic acid IUPAC Name: 2-[4-[(5-carbamimidoyl-1-benzofuran-2-carbonyl)amino]-N-pentanoylanilino]acetic acid Traditional Name: 2-[4-[(5-amidinobenzofuran-2-carbonyl)amino]-N-valeryl-anilino]acetic acid Formula: C23H24N4O5 MolecularWeight: 436.46046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24N4O5/c1-2-3-4-20(28)27(13-21(29)30)17-8-6-16(7-9-17)26-23(31)19-12-15-11-14(22(24)25)5-10-18(15)32-19/h5-12H,2-4,13H2,1H3,(H3,24,25)(H,26,31)(H,29,30)