[(E)-4-[1,2-bis(ethoxycarbonyl)pyrrolidin-3-yl]-4-ethyl-hex-1-enyl]phosphonic acid

Systemtic Name: [(E)-4-[1,2-bis(ethoxycarbonyl)pyrrolidin-3-yl]-4-ethyl-hex-1-enyl]phosphonic acid Openeye Name: [(E)-4-[1,2-bis(ethoxycarbonyl)pyrrolidin-3-yl]-4-ethyl-hex-1-enyl]phosphonic acid CAS Name: [(E)-4-[1,2-bis(ethoxycarbonyl)-3-pyrrolidinyl]-4-ethylhex-1-enyl]phosphonic acid IUPAC Name: [(E)-4-[1,2-bis(ethoxycarbonyl)pyrrolidin-3-yl]-4-ethylhex-1-enyl]phosphonic acid Traditional Name: [(E)-4-(1,2-dicarbethoxypyrrolidin-3-yl)-4-ethyl-hex-1-enyl]phosphonic acid Formula: C18H32NO7P MolecularWeight: 405.422941

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CC=CP(=O)(O)O)C1CCN(C1C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCC(CC)(C/C=C/P(=O)(O)O)C1CCN(C1C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C18H32NO7P/c1-5-18(6-2,11-9-13-27(22,23)24)14-10-12-19(17(21)26-8-4)15(14)16(20)25-7-3/h9,13-15H,5-8,10-12H2,1-4H3,(H2,22,23,24)/b13-9+