piperidin-1-yl 2-[(5-carbamimidoyl-1-benzofuran-2-yl)carbonylamino]propanoate

Systemtic Name: piperidin-1-yl 2-[(5-carbamimidoyl-1-benzofuran-2-yl)carbonylamino]propanoate Openeye Name: 1-piperidyl 2-[(5-carbamimidoylbenzofuran-2-carbonyl)amino]propanoate CAS Name: 2-[[(5-carbamimidoyl-2-benzofuranyl)-oxomethyl]amino]propanoic acid 1-piperidinyl ester IUPAC Name: piperidin-1-yl 2-[(5-carbamimidoyl-1-benzofuran-2-carbonyl)amino]propanoate Traditional Name: 2-[(5-amidinobenzofuran-2-carbonyl)amino]propionic acid piperidino ester Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N4O4/c1-11(18(24)26-22-7-3-2-4-8-22)21-17(23)15-10-13-9-12(16(19)20)5-6-14(13)25-15/h5-6,9-11H,2-4,7-8H2,1H3,(H3,19,20)(H,21,23)