3-azanylpropanoyl-(2-oxidanyl-2-phenylmethoxy-ethyl)carbamic acid; phosphoric acid

Systemtic Name: 3-azanylpropanoyl-(2-oxidanyl-2-phenylmethoxy-ethyl)carbamic acid; phosphoric acid Openeye Name: 3-aminopropanoyl-(2-benzyloxy-2-hydroxy-ethyl)carbamic acid; phosphoric acid CAS Name: (3-amino-1-oxopropyl)-(2-hydroxy-2-phenylmethoxyethyl)carbamic acid; phosphoric acid IUPAC Name: 3-aminopropanoyl-(2-hydroxy-2-phenylmethoxyethyl)carbamic acid; phosphoric acid Traditional Name: 3-aminopropanoyl-(2-benzoxy-2-hydroxy-ethyl)carbamic acid; phosphoric acid Formula: C13H21N2O9P MolecularWeight: 380.287601

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(CN(C(=O)CCN)C(=O)O)O.OP(=O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(CN(C(=O)CCN)C(=O)O)O.OP(=O)(O)O

InChI

InChI=1S/C13H18N2O5.H3O4P/c14-7-6-11(16)15(13(18)19)8-12(17)20-9-10-4-2-1-3-5-10;1-5(2,3)4/h1-5,12,17H,6-9,14H2,(H,18,19);(H3,1,2,3,4)