methyl 4-[[1-(3,3-dimethylbutanoyl)-3-(propan-2-ylcarbamoylamino)pyrrolidin-2-yl]carbonylamino]butanoate

Systemtic Name: methyl 4-[[1-(3,3-dimethylbutanoyl)-3-(propan-2-ylcarbamoylamino)pyrrolidin-2-yl]carbonylamino]butanoate Openeye Name: methyl 4-[[1-(3,3-dimethylbutanoyl)-3-(isopropylcarbamoylamino)pyrrolidine-2-carbonyl]amino]butanoate CAS Name: 4-[[[1-(3,3-dimethyl-1-oxobutyl)-3-[[oxo-(propan-2-ylamino)methyl]amino]-2-pyrrolidinyl]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[1-(3,3-dimethylbutanoyl)-3-(propan-2-ylcarbamoylamino)pyrrolidine-2-carbonyl]amino]butanoate Traditional Name: 4-[[1-(3,3-dimethylbutanoyl)-3-(isopropylcarbamoylamino)prolyl]amino]butyric acid methyl ester Formula: C20H36N4O5 MolecularWeight: 412.52364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1CCN(C1C(=O)NCCCC(=O)OC)C(=O)CC(C)(C)C

Isomeric SMILES

CC(C)NC(=O)NC1CCN(C1C(=O)NCCCC(=O)OC)C(=O)CC(C)(C)C

InChI

InChI=1S/C20H36N4O5/c1-13(2)22-19(28)23-14-9-11-24(15(25)12-20(3,4)5)17(14)18(27)21-10-7-8-16(26)29-6/h13-14,17H,7-12H2,1-6H3,(H,21,27)(H2,22,23,28)