methyl (2R,3R)-2-[2-(2-benzamidoethanoyloxy)ethanoylamino]-3-methyl-pentanoate

Systemtic Name: methyl (2R,3R)-2-[2-(2-benzamidoethanoyloxy)ethanoylamino]-3-methyl-pentanoate Openeye Name: methyl (2R,3R)-2-[[2-(2-benzamidoacetyl)oxyacetyl]amino]-3-methyl-pentanoate CAS Name: (2R,3R)-2-[[2-(2-benzamido-1-oxoethoxy)-1-oxoethyl]amino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl (2R,3R)-2-[[2-(2-benzamidoacetyl)oxyacetyl]amino]-3-methylpentanoate Traditional Name: (2R,3R)-2-[(2-hippuroyloxyacetyl)amino]-3-methyl-valeric acid methyl ester Formula: C18H24N2O6 MolecularWeight: 364.39296

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)COC(=O)CNC(=O)C1=CC=CC=C1

Isomeric SMILES

CC[C@@H](C)[C@H](C(=O)OC)NC(=O)COC(=O)CNC(=O)C1=CC=CC=C1

InChI

InChI=1S/C18H24N2O6/c1-4-12(2)16(18(24)25-3)20-14(21)11-26-15(22)10-19-17(23)13-8-6-5-7-9-13/h5-9,12,16H,4,10-11H2,1-3H3,(H,19,23)(H,20,21)/t12-,16-/m1/s1