[(E)-4-formamido-2,5-dimethyl-3-(phenylmethyl)-4-propan-2-yloxycarbonyl-hex-2-enyl]phosphonic acid

Systemtic Name: [(E)-4-formamido-2,5-dimethyl-3-(phenylmethyl)-4-propan-2-yloxycarbonyl-hex-2-enyl]phosphonic acid Openeye Name: [(E)-3-benzyl-4-formamido-4-isopropoxycarbonyl-2,5-dimethyl-hex-2-enyl]phosphonic acid CAS Name: [(E)-4-formamido-2,5-dimethyl-4-[oxo(propan-2-yloxy)methyl]-3-(phenylmethyl)hex-2-enyl]phosphonic acid IUPAC Name: [(E)-3-benzyl-4-formamido-2,5-dimethyl-4-propan-2-yloxycarbonylhex-2-enyl]phosphonic acid Traditional Name: [(E)-3-benzyl-4-formamido-4-isopropoxycarbonyl-2,5-dimethyl-hex-2-enyl]phosphonic acid Formula: C20H30NO6P MolecularWeight: 411.429061

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=C(C)CP(=O)(O)O)CC1=CC=CC=C1)(C(=O)OC(C)C)NC=O

Isomeric SMILES

CC(C)C(/C(=C(\C)/CP(=O)(O)O)/CC1=CC=CC=C1)(C(=O)OC(C)C)NC=O

InChI

InChI=1S/C20H30NO6P/c1-14(2)20(21-13-22,19(23)27-15(3)4)18(16(5)12-28(24,25)26)11-17-9-7-6-8-10-17/h6-10,13-15H,11-12H2,1-5H3,(H,21,22)(H2,24,25,26)/b18-16+