3-[[3-azanyl-3,7-dimethyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-octanoyl]amino]-5-methyl-hexanoic acid

Systemtic Name: 3-[[3-azanyl-3,7-dimethyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-octanoyl]amino]-5-methyl-hexanoic acid Openeye Name: 3-[[3-amino-5-(tert-butoxycarbonylamino)-3,7-dimethyl-4-oxo-octanoyl]amino]-5-methyl-hexanoic acid CAS Name: 3-[[3-amino-3,7-dimethyl-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1,4-dioxooctyl]amino]-5-methylhexanoic acid IUPAC Name: 3-[[3-amino-3,7-dimethyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxooctanoyl]amino]-5-methylhexanoic acid Traditional Name: 3-[[3-amino-5-(tert-butoxycarbonylamino)-4-keto-3,7-dimethyl-octanoyl]amino]-5-methyl-hexanoic acid Formula: C22H41N3O6 MolecularWeight: 443.57744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H41N3O6/c1-13(2)9-15(11-18(27)28)24-17(26)12-22(8,23)19(29)16(10-14(3)4)25-20(30)31-21(5,6)7/h13-16H,9-12,23H2,1-8H3,(H,24,26)(H,25,30)(H,27,28)