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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)(NC(=O)C1=CC2=C(O1)C=CC(=C2)C(=N)N)N3CCCCC3

Isomeric SMILES

CC(C(=O)O)(NC(=O)C1=CC2=C(O1)C=CC(=C2)C(=N)N)N3CCCCC3

InChI

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