[(3R)-4-azanylidene-3-cyano-2-oxidanylidene-pentyl] 4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzoate

Systemtic Name: [(3R)-4-azanylidene-3-cyano-2-oxidanylidene-pentyl] 4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzoate Openeye Name: [(3R)-3-cyano-4-imino-2-oxo-pentyl] 4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzoate CAS Name: 4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzoic acid [(3R)-3-cyano-4-imino-2-oxopentyl] ester IUPAC Name: [(3R)-3-cyano-4-imino-2-oxopentyl] 4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzoate Traditional Name: 4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzoic acid [(3R)-3-cyano-4-imino-2-keto-pentyl] ester Formula: C17H16N4O5 MolecularWeight: 356.33274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NO1)COC2=CC=C(C=C2)C(=O)OCC(=O)C(C#N)C(=N)C

Isomeric SMILES

CC1=NC(=NO1)COC2=CC=C(C=C2)C(=O)OCC(=O)[C@@H](C#N)C(=N)C

InChI

InChI=1S/C17H16N4O5/c1-10(19)14(7-18)15(22)8-25-17(23)12-3-5-13(6-4-12)24-9-16-20-11(2)26-21-16/h3-6,14,19H,8-9H2,1-2H3/t14-/m0/s1