N-(6-azanyl-1-oxidanyl-3-oxidanylidene-hexan-2-yl)benzamide; phosphoric acid

Systemtic Name: N-(6-azanyl-1-oxidanyl-3-oxidanylidene-hexan-2-yl)benzamide; phosphoric acid Openeye Name: N-[5-amino-1-(hydroxymethyl)-2-oxo-pentyl]benzamide; phosphoric acid CAS Name: N-(6-amino-1-hydroxy-3-oxohexan-2-yl)benzamide; phosphoric acid IUPAC Name: N-(6-amino-1-hydroxy-3-oxohexan-2-yl)benzamide; phosphoric acid Traditional Name: N-(5-amino-2-keto-1-methylol-pentyl)benzamide; phosphoric acid Formula: C13H21N2O7P MolecularWeight: 348.288801

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(CO)C(=O)CCCN.OP(=O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(CO)C(=O)CCCN.OP(=O)(O)O

InChI

InChI=1S/C13H18N2O3.H3O4P/c14-8-4-7-12(17)11(9-16)15-13(18)10-5-2-1-3-6-10;1-5(2,3)4/h1-3,5-6,11,16H,4,7-9,14H2,(H,15,18);(H3,1,2,3,4)