[2-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]phenyl]phosphonic acid

Systemtic Name: [2-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]phenyl]phosphonic acid Openeye Name: [2-[2-(azepan-1-yl)-2-oxo-ethoxy]phenyl]phosphonic acid CAS Name: [2-[2-(1-azepanyl)-2-oxoethoxy]phenyl]phosphonic acid IUPAC Name: [2-[2-(azepan-1-yl)-2-oxoethoxy]phenyl]phosphonic acid Traditional Name: [2-[2-(azepan-1-yl)-2-keto-ethoxy]phenyl]phosphonic acid Formula: C14H20NO5P MolecularWeight: 313.286061

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)COC2=CC=CC=C2P(=O)(O)O

Isomeric SMILES

C1CCCN(CC1)C(=O)COC2=CC=CC=C2P(=O)(O)O

InChI

InChI=1S/C14H20NO5P/c16-14(15-9-5-1-2-6-10-15)11-20-12-7-3-4-8-13(12)21(17,18)19/h3-4,7-8H,1-2,5-6,9-11H2,(H2,17,18,19)