2-azanyl-5-oxidanylidene-5-phenylmethoxy-pentanoic acid; methanesulfonic acid

Systemtic Name: 2-azanyl-5-oxidanylidene-5-phenylmethoxy-pentanoic acid; methanesulfonic acid Openeye Name: 2-amino-5-benzyloxy-5-oxo-pentanoic acid; methanesulfonic acid CAS Name: 2-amino-5-oxo-5-phenylmethoxypentanoic acid; methanesulfonic acid IUPAC Name: 2-amino-5-oxo-5-phenylmethoxypentanoic acid; methanesulfonic acid Traditional Name: 2-amino-5-benzoxy-5-keto-valeric acid; mesylic acid Formula: C13H19NO7S MolecularWeight: 333.35746

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)O.C1=CC=C(C=C1)COC(=O)CCC(C(=O)O)N

Isomeric SMILES

CS(=O)(=O)O.C1=CC=C(C=C1)COC(=O)CCC(C(=O)O)N

InChI

InChI=1S/C12H15NO4.CH4O3S/c13-10(12(15)16)6-7-11(14)17-8-9-4-2-1-3-5-9;1-5(2,3)4/h1-5,10H,6-8,13H2,(H,15,16);1H3,(H,2,3,4)