3-[2-[5-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoylamino]ethanoylamino]-2-pyridin-3-yl-propanoic acid

Systemtic Name: 3-[2-[5-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoylamino]ethanoylamino]-2-pyridin-3-yl-propanoic acid Openeye Name: 3-[[2-[5-(tert-butoxycarbonylamino)pentanoylamino]acetyl]amino]-2-(3-pyridyl)propanoic acid CAS Name: 3-[[2-[[5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopentyl]amino]-1-oxoethyl]amino]-2-(3-pyridinyl)propanoic acid IUPAC Name: 3-[[2-[5-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoylamino]acetyl]amino]-2-pyridin-3-ylpropanoic acid Traditional Name: 3-[[2-[5-(tert-butoxycarbonylamino)pentanoylamino]acetyl]amino]-2-(3-pyridyl)propionic acid Formula: C20H30N4O6 MolecularWeight: 422.4754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCC(=O)NCC(=O)NCC(C1=CN=CC=C1)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NCCCCC(=O)NCC(=O)NCC(C1=CN=CC=C1)C(=O)O

InChI

InChI=1S/C20H30N4O6/c1-20(2,3)30-19(29)22-10-5-4-8-16(25)24-13-17(26)23-12-15(18(27)28)14-7-6-9-21-11-14/h6-7,9,11,15H,4-5,8,10,12-13H2,1-3H3,(H,22,29)(H,23,26)(H,24,25)(H,27,28)