(2R)-6-azanyl-2-[2-[1-benzofuran-2-ylcarbonyl(carboxymethyl)amino]ethanoylamino]hexanoic acid

Systemtic Name: (2R)-6-azanyl-2-[2-[1-benzofuran-2-ylcarbonyl(carboxymethyl)amino]ethanoylamino]hexanoic acid Openeye Name: (2R)-6-amino-2-[[2-[benzofuran-2-carbonyl(carboxymethyl)amino]acetyl]amino]hexanoic acid CAS Name: (2R)-6-amino-2-[[2-[[2-benzofuranyl(oxo)methyl]-(carboxymethyl)amino]-1-oxoethyl]amino]hexanoic acid IUPAC Name: (2R)-6-amino-2-[[2-[1-benzofuran-2-carbonyl(carboxymethyl)amino]acetyl]amino]hexanoic acid Traditional Name: (2R)-6-amino-2-[[2-[benzofuran-2-carbonyl(carboxymethyl)amino]acetyl]amino]hexanoic acid Formula: C19H23N3O7 MolecularWeight: 405.40182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)C(=O)N(CC(=O)NC(CCCCN)C(=O)O)CC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)C(=O)N(CC(=O)N[C@H](CCCCN)C(=O)O)CC(=O)O

InChI

InChI=1S/C19H23N3O7/c20-8-4-3-6-13(19(27)28)21-16(23)10-22(11-17(24)25)18(26)15-9-12-5-1-2-7-14(12)29-15/h1-2,5,7,9,13H,3-4,6,8,10-11,20H2,(H,21,23)(H,24,25)(H,27,28)/t13-/m1/s1