[2-[2-[cyclohex-3-en-1-ylmethyl(oxolan-2-ylmethyl)amino]ethanoyloxy]phenyl]phosphonic acid

Systemtic Name: [2-[2-[cyclohex-3-en-1-ylmethyl(oxolan-2-ylmethyl)amino]ethanoyloxy]phenyl]phosphonic acid Openeye Name: [2-[2-[cyclohex-3-en-1-ylmethyl(tetrahydrofuran-2-ylmethyl)amino]acetyl]oxyphenyl]phosphonic acid CAS Name: [2-[2-[1-cyclohex-3-enylmethyl(2-oxolanylmethyl)amino]-1-oxoethoxy]phenyl]phosphonic acid IUPAC Name: [2-[2-[cyclohex-3-en-1-ylmethyl(oxolan-2-ylmethyl)amino]acetyl]oxyphenyl]phosphonic acid Traditional Name: [2-[2-[cyclohex-3-en-1-ylmethyl(tetrahydrofurfuryl)amino]acetyl]oxyphenyl]phosphonic acid Formula: C20H28NO6P MolecularWeight: 409.413181

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN(CC2CCC=CC2)CC(=O)OC3=CC=CC=C3P(=O)(O)O

Isomeric SMILES

C1CC(OC1)CN(CC2CCC=CC2)CC(=O)OC3=CC=CC=C3P(=O)(O)O

InChI

InChI=1S/C20H28NO6P/c22-20(27-18-10-4-5-11-19(18)28(23,24)25)15-21(14-17-9-6-12-26-17)13-16-7-2-1-3-8-16/h1-2,4-5,10-11,16-17H,3,6-9,12-15H2,(H2,23,24,25)