3-[[3-(4-methoxyphenyl)-1-(methylamino)-1-oxidanylidene-propan-2-yl]carbamoyl]-2,5-dimethyl-hexanoic acid

Systemtic Name: 3-[[3-(4-methoxyphenyl)-1-(methylamino)-1-oxidanylidene-propan-2-yl]carbamoyl]-2,5-dimethyl-hexanoic acid Openeye Name: 3-[[1-[(4-methoxyphenyl)methyl]-2-(methylamino)-2-oxo-ethyl]carbamoyl]-2,5-dimethyl-hexanoic acid CAS Name: 3-[[[3-(4-methoxyphenyl)-1-(methylamino)-1-oxopropan-2-yl]amino]-oxomethyl]-2,5-dimethylhexanoic acid IUPAC Name: 3-[[3-(4-methoxyphenyl)-1-(methylamino)-1-oxopropan-2-yl]carbamoyl]-2,5-dimethylhexanoic acid Traditional Name: 3-[[2-keto-2-(methylamino)-1-p-anisyl-ethyl]carbamoyl]-2,5-dimethyl-hexanoic acid Formula: C20H30N2O5 MolecularWeight: 378.4626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(C)C(=O)O)C(=O)NC(CC1=CC=C(C=C1)OC)C(=O)NC

Isomeric SMILES

CC(C)CC(C(C)C(=O)O)C(=O)NC(CC1=CC=C(C=C1)OC)C(=O)NC

InChI

InChI=1S/C20H30N2O5/c1-12(2)10-16(13(3)20(25)26)18(23)22-17(19(24)21-4)11-14-6-8-15(27-5)9-7-14/h6-9,12-13,16-17H,10-11H2,1-5H3,(H,21,24)(H,22,23)(H,25,26)