3-[3-methyl-5-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butyl]-6-oxidanylidene-1H-pyrazin-2-yl]propanoic acid

Systemtic Name: 3-[3-methyl-5-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butyl]-6-oxidanylidene-1H-pyrazin-2-yl]propanoic acid Openeye Name: 3-[5-[4-(tert-butoxycarbonylamino)butyl]-3-methyl-6-oxo-1H-pyrazin-2-yl]propanoic acid CAS Name: 3-[3-methyl-5-[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butyl]-6-oxo-1H-pyrazin-2-yl]propanoic acid IUPAC Name: 3-[3-methyl-5-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butyl]-6-oxo-1H-pyrazin-2-yl]propanoic acid Traditional Name: 3-[5-[4-(tert-butoxycarbonylamino)butyl]-6-keto-3-methyl-1H-pyrazin-2-yl]propionic acid Formula: C17H27N3O5 MolecularWeight: 353.41338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=O)C(=N1)CCCCNC(=O)OC(C)(C)C)CCC(=O)O

Isomeric SMILES

CC1=C(NC(=O)C(=N1)CCCCNC(=O)OC(C)(C)C)CCC(=O)O

InChI

InChI=1S/C17H27N3O5/c1-11-12(8-9-14(21)22)20-15(23)13(19-11)7-5-6-10-18-16(24)25-17(2,3)4/h5-10H2,1-4H3,(H,18,24)(H,20,23)(H,21,22)