[[6-[2-(4-hydroxyphenyl)-1-oxidanyl-butyl]-3-oxidanylidene-cyclohexa-1,4-dien-1-yl]amino]phosphonic acid

Systemtic Name: [[6-[2-(4-hydroxyphenyl)-1-oxidanyl-butyl]-3-oxidanylidene-cyclohexa-1,4-dien-1-yl]amino]phosphonic acid Openeye Name: [[6-[1-hydroxy-2-(4-hydroxyphenyl)butyl]-3-oxo-cyclohexa-1,4-dien-1-yl]amino]phosphonic acid CAS Name: [[6-[1-hydroxy-2-(4-hydroxyphenyl)butyl]-3-oxo-1-cyclohexa-1,4-dienyl]amino]phosphonic acid IUPAC Name: [[6-[1-hydroxy-2-(4-hydroxyphenyl)butyl]-3-oxocyclohexa-1,4-dien-1-yl]amino]phosphonic acid Traditional Name: [[6-[1-hydroxy-2-(4-hydroxyphenyl)butyl]-3-keto-cyclohexa-1,4-dien-1-yl]amino]phosphonic acid Formula: C16H20NO6P MolecularWeight: 353.306861

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)O)C(C2C=CC(=O)C=C2NP(=O)(O)O)O

Isomeric SMILES

CCC(C1=CC=C(C=C1)O)C(C2C=CC(=O)C=C2NP(=O)(O)O)O

InChI

InChI=1S/C16H20NO6P/c1-2-13(10-3-5-11(18)6-4-10)16(20)14-8-7-12(19)9-15(14)17-24(21,22)23/h3-9,13-14,16,18,20H,2H2,1H3,(H3,17,21,22,23)