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

Systemtic Name: [[6-[2-(4-hydroxyphenyl)butyl]-3-oxidanylidene-cyclohexa-1,4-dien-1-yl]amino]phosphonic acid Openeye Name: [[6-[2-(4-hydroxyphenyl)butyl]-3-oxo-cyclohexa-1,4-dien-1-yl]amino]phosphonic acid CAS Name: [[6-[2-(4-hydroxyphenyl)butyl]-3-oxo-1-cyclohexa-1,4-dienyl]amino]phosphonic acid IUPAC Name: [[6-[2-(4-hydroxyphenyl)butyl]-3-oxocyclohexa-1,4-dien-1-yl]amino]phosphonic acid Traditional Name: [[6-[2-(4-hydroxyphenyl)butyl]-3-keto-cyclohexa-1,4-dien-1-yl]amino]phosphonic acid Formula: C16H20NO5P MolecularWeight: 337.307461

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1C=CC(=O)C=C1NP(=O)(O)O)C2=CC=C(C=C2)O

Isomeric SMILES

CCC(CC1C=CC(=O)C=C1NP(=O)(O)O)C2=CC=C(C=C2)O

InChI

InChI=1S/C16H20NO5P/c1-2-11(12-3-6-14(18)7-4-12)9-13-5-8-15(19)10-16(13)17-23(20,21)22/h3-8,10-11,13,18H,2,9H2,1H3,(H3,17,20,21,22)