tert-butyl 2-[[2-(4-azanylbutanoylamino)-4-[(2-methylpropan-2-yl)oxy]-4-oxidanylidene-butanoyl]amino]-3-methyl-butanoate

Systemtic Name: tert-butyl 2-[[2-(4-azanylbutanoylamino)-4-[(2-methylpropan-2-yl)oxy]-4-oxidanylidene-butanoyl]amino]-3-methyl-butanoate Openeye Name: tert-butyl 2-[[2-(4-aminobutanoylamino)-4-tert-butoxy-4-oxo-butanoyl]amino]-3-methyl-butanoate CAS Name: 2-[[2-[(4-amino-1-oxobutyl)amino]-4-[(2-methylpropan-2-yl)oxy]-1,4-dioxobutyl]amino]-3-methylbutanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[2-(4-aminobutanoylamino)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoyl]amino]-3-methylbutanoate Traditional Name: 2-[[2-(4-aminobutanoylamino)-4-tert-butoxy-4-keto-butanoyl]amino]-3-methyl-butyric acid tert-butyl ester Formula: C21H39N3O6 MolecularWeight: 429.55086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC(C)(C)C)NC(=O)C(CC(=O)OC(C)(C)C)NC(=O)CCCN

Isomeric SMILES

CC(C)C(C(=O)OC(C)(C)C)NC(=O)C(CC(=O)OC(C)(C)C)NC(=O)CCCN

InChI

InChI=1S/C21H39N3O6/c1-13(2)17(19(28)30-21(6,7)8)24-18(27)14(23-15(25)10-9-11-22)12-16(26)29-20(3,4)5/h13-14,17H,9-12,22H2,1-8H3,(H,23,25)(H,24,27)