[6-methyl-1-oxidanylidene-4-(2-oxidanylidene-1-phenethyl-pyrrolidin-3-yl)heptan-4-yl]oxycarbonylcarbamic acid

Systemtic Name: [6-methyl-1-oxidanylidene-4-(2-oxidanylidene-1-phenethyl-pyrrolidin-3-yl)heptan-4-yl]oxycarbonylcarbamic acid Openeye Name: [3-methyl-1-(2-oxo-1-phenethyl-pyrrolidin-3-yl)-1-(3-oxopropyl)butoxy]carbonylcarbamic acid CAS Name: [[6-methyl-1-oxo-4-(2-oxo-1-phenethyl-3-pyrrolidinyl)heptan-4-yl]oxy-oxomethyl]carbamic acid IUPAC Name: [6-methyl-1-oxo-4-(2-oxo-1-phenethylpyrrolidin-3-yl)heptan-4-yl]oxycarbonylcarbamic acid Traditional Name: [1-(2-keto-1-phenethyl-pyrrolidin-3-yl)-1-(3-ketopropyl)-3-methyl-butoxy]carbonylcarbamic acid Formula: C22H30N2O6 MolecularWeight: 418.4834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CCC=O)(C1CCN(C1=O)CCC2=CC=CC=C2)OC(=O)NC(=O)O

Isomeric SMILES

CC(C)CC(CCC=O)(C1CCN(C1=O)CCC2=CC=CC=C2)OC(=O)NC(=O)O

InChI

InChI=1S/C22H30N2O6/c1-16(2)15-22(11-6-14-25,30-21(29)23-20(27)28)18-10-13-24(19(18)26)12-9-17-7-4-3-5-8-17/h3-5,7-8,14,16,18H,6,9-13,15H2,1-2H3,(H,23,29)(H,27,28)