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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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