ethyl 2-[[2-(diethoxyphosphorylmethyl)-3-phenyl-propanoyl]amino]-4-methyl-pentanoate

Systemtic Name: ethyl 2-[[2-(diethoxyphosphorylmethyl)-3-phenyl-propanoyl]amino]-4-methyl-pentanoate Openeye Name: ethyl 2-[(2-benzyl-3-diethoxyphosphoryl-propanoyl)amino]-4-methyl-pentanoate CAS Name: 2-[[2-(diethoxyphosphorylmethyl)-1-oxo-3-phenylpropyl]amino]-4-methylpentanoic acid ethyl ester IUPAC Name: ethyl 2-[(2-benzyl-3-diethoxyphosphorylpropanoyl)amino]-4-methylpentanoate Traditional Name: 2-[(2-benzyl-3-diethoxyphosphoryl-propanoyl)amino]-4-methyl-valeric acid ethyl ester Formula: C22H36NO6P MolecularWeight: 441.498101

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C)C)NC(=O)C(CC1=CC=CC=C1)CP(=O)(OCC)OCC

Isomeric SMILES

CCOC(=O)C(CC(C)C)NC(=O)C(CC1=CC=CC=C1)CP(=O)(OCC)OCC

InChI

InChI=1S/C22H36NO6P/c1-6-27-22(25)20(14-17(4)5)23-21(24)19(15-18-12-10-9-11-13-18)16-30(26,28-7-2)29-8-3/h9-13,17,19-20H,6-8,14-16H2,1-5H3,(H,23,24)