[[6-[4-(3-hydroxyphenyl)butanoyl]-5-oxidanylidene-cyclohexa-1,3-dien-1-yl]amino]phosphonic acid

Systemtic Name: [[6-[4-(3-hydroxyphenyl)butanoyl]-5-oxidanylidene-cyclohexa-1,3-dien-1-yl]amino]phosphonic acid Openeye Name: [[6-[4-(3-hydroxyphenyl)butanoyl]-5-oxo-cyclohexa-1,3-dien-1-yl]amino]phosphonic acid CAS Name: [[6-[4-(3-hydroxyphenyl)-1-oxobutyl]-5-oxo-1-cyclohexa-1,3-dienyl]amino]phosphonic acid IUPAC Name: [[6-[4-(3-hydroxyphenyl)butanoyl]-5-oxocyclohexa-1,3-dien-1-yl]amino]phosphonic acid Traditional Name: [[6-[4-(3-hydroxyphenyl)butanoyl]-5-keto-cyclohexa-1,3-dien-1-yl]amino]phosphonic acid Formula: C16H18NO6P MolecularWeight: 351.290981

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18NO6P/c18-12-6-1-4-11(10-12)5-2-8-14(19)16-13(17-24(21,22)23)7-3-9-15(16)20/h1,3-4,6-7,9-10,16,18H,2,5,8H2,(H3,17,21,22,23)