5-(4-ethoxyphenoxy)-3-[[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]pentanoic acid

Systemtic Name: 5-(4-ethoxyphenoxy)-3-[[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]pentanoic acid Openeye Name: 3-[[1-benzyl-2-(methylamino)-2-oxo-ethyl]carbamoyl]-5-(4-ethoxyphenoxy)pentanoic acid CAS Name: 5-(4-ethoxyphenoxy)-3-[[[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]pentanoic acid IUPAC Name: 5-(4-ethoxyphenoxy)-3-[[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]carbamoyl]pentanoic acid Traditional Name: 3-[[1-benzyl-2-keto-2-(methylamino)ethyl]carbamoyl]-5-(4-ethoxyphenoxy)valeric acid Formula: C24H30N2O6 MolecularWeight: 442.5048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCC(CC(=O)O)C(=O)NC(CC2=CC=CC=C2)C(=O)NC

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCC(CC(=O)O)C(=O)NC(CC2=CC=CC=C2)C(=O)NC

InChI

InChI=1S/C24H30N2O6/c1-3-31-19-9-11-20(12-10-19)32-14-13-18(16-22(27)28)23(29)26-21(24(30)25-2)15-17-7-5-4-6-8-17/h4-12,18,21H,3,13-16H2,1-2H3,(H,25,30)(H,26,29)(H,27,28)