2-[[4-azanyl-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoylamino]-4-oxidanylidene-butanoyl]amino]ethanoic acid

Systemtic Name: 2-[[4-azanyl-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoylamino]-4-oxidanylidene-butanoyl]amino]ethanoic acid Openeye Name: 2-[[4-amino-2-[[2-(tert-butoxycarbonylamino)acetyl]amino]-4-oxo-butanoyl]amino]acetic acid CAS Name: 2-[[4-amino-2-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxoethyl]amino]-1,4-dioxobutyl]amino]acetic acid IUPAC Name: 2-[[4-amino-2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]acetyl]amino]-4-oxobutanoyl]amino]acetic acid Traditional Name: 2-[[4-amino-2-[[2-(tert-butoxycarbonylamino)acetyl]amino]-4-keto-butanoyl]amino]acetic acid Formula: C13H22N4O7 MolecularWeight: 346.33638

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H22N4O7/c1-13(2,3)24-12(23)16-5-9(19)17-7(4-8(14)18)11(22)15-6-10(20)21/h7H,4-6H2,1-3H3,(H2,14,18)(H,15,22)(H,16,23)(H,17,19)(H,20,21)