(2R)-2-[4-[(E)-2-cyano-3-morpholin-4-yl-3-oxidanylidene-prop-1-enyl]phenoxy]propanoate

Systemtic Name: (2R)-2-[4-[(E)-2-cyano-3-morpholin-4-yl-3-oxidanylidene-prop-1-enyl]phenoxy]propanoate Openeye Name: (2R)-2-[4-[(E)-2-cyano-3-morpholino-3-oxo-prop-1-enyl]phenoxy]propanoate CAS Name: (2R)-2-[4-[(E)-2-cyano-3-(4-morpholinyl)-3-oxoprop-1-enyl]phenoxy]propanoate IUPAC Name: (2R)-2-[4-[(E)-2-cyano-3-morpholin-4-yl-3-oxoprop-1-enyl]phenoxy]propanoate Traditional Name: (2R)-2-[4-[(E)-2-cyano-3-keto-3-morpholino-prop-1-enyl]phenoxy]propionate Formula: C17H17N2O5- MolecularWeight: 329.32728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])OC1=CC=C(C=C1)C=C(C#N)C(=O)N2CCOCC2

Isomeric SMILES

C[C@H](C(=O)[O-])OC1=CC=C(C=C1)/C=C(\C#N)/C(=O)N2CCOCC2

InChI

InChI=1S/C17H18N2O5/c1-12(17(21)22)24-15-4-2-13(3-5-15)10-14(11-18)16(20)19-6-8-23-9-7-19/h2-5,10,12H,6-9H2,1H3,(H,21,22)/p-1/b14-10+/t12-/m1/s1