3-[[3,3-dimethyl-1-(methylamino)-1-oxidanylidene-butan-2-yl]carbamoyl]-6-(4-methoxyphenoxy)hexanoic acid

Systemtic Name: 3-[[3,3-dimethyl-1-(methylamino)-1-oxidanylidene-butan-2-yl]carbamoyl]-6-(4-methoxyphenoxy)hexanoic acid Openeye Name: 3-[[2,2-dimethyl-1-(methylcarbamoyl)propyl]carbamoyl]-6-(4-methoxyphenoxy)hexanoic acid CAS Name: 3-[[[3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]amino]-oxomethyl]-6-(4-methoxyphenoxy)hexanoic acid IUPAC Name: 3-[[3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]-6-(4-methoxyphenoxy)hexanoic acid Traditional Name: 3-[[2,2-dimethyl-1-(methylcarbamoyl)propyl]carbamoyl]-6-(4-methoxyphenoxy)hexanoic acid Formula: C21H32N2O6 MolecularWeight: 408.48858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)NC)NC(=O)C(CCCOC1=CC=C(C=C1)OC)CC(=O)O

Isomeric SMILES

CC(C)(C)C(C(=O)NC)NC(=O)C(CCCOC1=CC=C(C=C1)OC)CC(=O)O

InChI

InChI=1S/C21H32N2O6/c1-21(2,3)18(20(27)22-4)23-19(26)14(13-17(24)25)7-6-12-29-16-10-8-15(28-5)9-11-16/h8-11,14,18H,6-7,12-13H2,1-5H3,(H,22,27)(H,23,26)(H,24,25)