3-[azepan-1-ium-1-ylmethyl(oxidanidyl)phosphoryl]propanoate

Systemtic Name: 3-[azepan-1-ium-1-ylmethyl(oxidanidyl)phosphoryl]propanoate Openeye Name: 3-[azepan-1-ium-1-ylmethyl(oxido)phosphoryl]propanoate CAS Name: 3-[1-azepan-1-iumylmethyl(oxido)phosphoryl]propanoate IUPAC Name: 3-[azepan-1-ium-1-ylmethyl(oxido)phosphoryl]propanoate Traditional Name: 3-[azepan-1-ium-1-ylmethyl(oxido)phosphoryl]propionate Formula: C10H19NO4P- MolecularWeight: 248.235921

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CP(=O)(CCC(=O)[O-])[O-]

Isomeric SMILES

C1CCC[NH+](CC1)CP(=O)(CCC(=O)[O-])[O-]

InChI

InChI=1S/C10H20NO4P/c12-10(13)5-8-16(14,15)9-11-6-3-1-2-4-7-11/h1-9H2,(H,12,13)(H,14,15)/p-1