piperidin-1-yl 2-[[5-[(E)-N'-methoxycarbonylcarbamimidoyl]-1-benzofuran-2-yl]carbonylamino]propanoate

Systemtic Name: piperidin-1-yl 2-[[5-[(E)-N'-methoxycarbonylcarbamimidoyl]-1-benzofuran-2-yl]carbonylamino]propanoate Openeye Name: 1-piperidyl 2-[[5-[(E)-N'-methoxycarbonylcarbamimidoyl]benzofuran-2-carbonyl]amino]propanoate CAS Name: 2-[[[5-[(E)-amino(methoxycarbonylimino)methyl]-2-benzofuranyl]-oxomethyl]amino]propanoic acid 1-piperidinyl ester IUPAC Name: piperidin-1-yl 2-[[5-[(E)-N'-methoxycarbonylcarbamimidoyl]-1-benzofuran-2-carbonyl]amino]propanoate Traditional Name: 2-[[5-[(E)-N'-carbomethoxyamidino]benzofuran-2-carbonyl]amino]propionic acid piperidino ester Formula: C20H24N4O6 MolecularWeight: 416.42776

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)ON1CCCCC1)NC(=O)C2=CC3=C(O2)C=CC(=C3)C(=NC(=O)OC)N

Isomeric SMILES

CC(C(=O)ON1CCCCC1)NC(=O)C2=CC3=C(O2)C=CC(=C3)/C(=N\C(=O)OC)/N

InChI

InChI=1S/C20H24N4O6/c1-12(19(26)30-24-8-4-3-5-9-24)22-18(25)16-11-14-10-13(6-7-15(14)29-16)17(21)23-20(27)28-2/h6-7,10-12H,3-5,8-9H2,1-2H3,(H,22,25)(H2,21,23,27)