3-(1,3-benzodioxol-5-yl)-4-[3-[3-(5,5-dimethyl-7,8-dihydro-6H-1,8-naphthyridin-2-yl)propyl]-1,2,4-oxadiazol-5-yl]butanoic acid

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-4-[3-[3-(5,5-dimethyl-7,8-dihydro-6H-1,8-naphthyridin-2-yl)propyl]-1,2,4-oxadiazol-5-yl]butanoic acid Openeye Name: 3-(1,3-benzodioxol-5-yl)-4-[3-[3-(5,5-dimethyl-7,8-dihydro-6H-1,8-naphthyridin-2-yl)propyl]-1,2,4-oxadiazol-5-yl]butanoic acid CAS Name: 3-(1,3-benzodioxol-5-yl)-4-[3-[3-(5,5-dimethyl-7,8-dihydro-6H-1,8-naphthyridin-2-yl)propyl]-1,2,4-oxadiazol-5-yl]butanoic acid IUPAC Name: 3-(1,3-benzodioxol-5-yl)-4-[3-[3-(5,5-dimethyl-7,8-dihydro-6H-1,8-naphthyridin-2-yl)propyl]-1,2,4-oxadiazol-5-yl]butanoic acid Traditional Name: 3-(1,3-benzodioxol-5-yl)-4-[3-[3-(5,5-dimethyl-7,8-dihydro-6H-1,8-naphthyridin-2-yl)propyl]-1,2,4-oxadiazol-5-yl]butyric acid Formula: C26H30N4O5 MolecularWeight: 478.5402

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCNC2=C1C=CC(=N2)CCCC3=NOC(=N3)CC(CC(=O)O)C4=CC5=C(C=C4)OCO5)C

Isomeric SMILES

CC1(CCNC2=C1C=CC(=N2)CCCC3=NOC(=N3)CC(CC(=O)O)C4=CC5=C(C=C4)OCO5)C

InChI

InChI=1S/C26H30N4O5/c1-26(2)10-11-27-25-19(26)8-7-18(28-25)4-3-5-22-29-23(35-30-22)13-17(14-24(31)32)16-6-9-20-21(12-16)34-15-33-20/h6-9,12,17H,3-5,10-11,13-15H2,1-2H3,(H,27,28)(H,31,32)