(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[3-[3-(1,8-naphthyridin-2-yl)propyl]-1,2,4-oxadiazol-5-yl]propanoic acid

Systemtic Name: (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[3-[3-(1,8-naphthyridin-2-yl)propyl]-1,2,4-oxadiazol-5-yl]propanoic acid Openeye Name: (2S)-2-(tert-butoxycarbonylamino)-3-[3-[3-(1,8-naphthyridin-2-yl)propyl]-1,2,4-oxadiazol-5-yl]propanoic acid CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-[3-[3-(1,8-naphthyridin-2-yl)propyl]-1,2,4-oxadiazol-5-yl]propanoic acid IUPAC Name: (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[3-[3-(1,8-naphthyridin-2-yl)propyl]-1,2,4-oxadiazol-5-yl]propanoic acid Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-3-[3-[3-(1,8-naphthyridin-2-yl)propyl]-1,2,4-oxadiazol-5-yl]propionic acid Formula: C21H25N5O5 MolecularWeight: 427.4537

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=NC(=NO1)CCCC2=NC3=C(C=CC=N3)C=C2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=NC(=NO1)CCCC2=NC3=C(C=CC=N3)C=C2)C(=O)O

InChI

InChI=1S/C21H25N5O5/c1-21(2,3)30-20(29)24-15(19(27)28)12-17-25-16(26-31-17)8-4-7-14-10-9-13-6-5-11-22-18(13)23-14/h5-6,9-11,15H,4,7-8,12H2,1-3H3,(H,24,29)(H,27,28)/t15-/m0/s1