phenanthridin-6-ylmethyl 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoate

Systemtic Name: phenanthridin-6-ylmethyl 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoate Openeye Name: phenanthridin-6-ylmethyl 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoate CAS Name: 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoic acid 6-phenanthridinylmethyl ester IUPAC Name: phenanthridin-6-ylmethyl 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoate Traditional Name: 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propionic acid phenanthridin-6-ylmethyl ester Formula: C26H21N3O4 MolecularWeight: 439.46264

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NOC(=N2)CCC(=O)OCC3=NC4=CC=CC=C4C5=CC=CC=C53

Isomeric SMILES

COC1=CC=C(C=C1)C2=NOC(=N2)CCC(=O)OCC3=NC4=CC=CC=C4C5=CC=CC=C53

InChI

InChI=1S/C26H21N3O4/c1-31-18-12-10-17(11-13-18)26-28-24(33-29-26)14-15-25(30)32-16-23-21-8-3-2-6-19(21)20-7-4-5-9-22(20)27-23/h2-13H,14-16H2,1H3