5-ethoxy-2-(2-methylpropylcarbamoylamino)-4-oxidanyl-5-oxidanylidene-2-phenethyl-pentanoic acid

Systemtic Name: 5-ethoxy-2-(2-methylpropylcarbamoylamino)-4-oxidanyl-5-oxidanylidene-2-phenethyl-pentanoic acid Openeye Name: 5-ethoxy-4-hydroxy-2-(isobutylcarbamoylamino)-5-oxo-2-phenethyl-pentanoic acid CAS Name: 5-ethoxy-4-hydroxy-2-[[(2-methylpropylamino)-oxomethyl]amino]-5-oxo-2-phenethylpentanoic acid IUPAC Name: 5-ethoxy-4-hydroxy-2-(2-methylpropylcarbamoylamino)-5-oxo-2-phenethylpentanoic acid Traditional Name: 5-ethoxy-4-hydroxy-2-(isobutylcarbamoylamino)-5-keto-2-phenethyl-valeric acid Formula: C20H30N2O6 MolecularWeight: 394.462

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(CCC1=CC=CC=C1)(C(=O)O)NC(=O)NCC(C)C)O

Isomeric SMILES

CCOC(=O)C(CC(CCC1=CC=CC=C1)(C(=O)O)NC(=O)NCC(C)C)O

InChI

InChI=1S/C20H30N2O6/c1-4-28-17(24)16(23)12-20(18(25)26,22-19(27)21-13-14(2)3)11-10-15-8-6-5-7-9-15/h5-9,14,16,23H,4,10-13H2,1-3H3,(H,25,26)(H2,21,22,27)