3-cyano-4-oxidanylidene-4-[(3-phenoxyphenyl)methoxy]butanoate

Systemtic Name: 3-cyano-4-oxidanylidene-4-[(3-phenoxyphenyl)methoxy]butanoate Openeye Name: 3-cyano-4-oxo-4-[(3-phenoxyphenyl)methoxy]butanoate CAS Name: 3-cyano-4-oxo-4-[(3-phenoxyphenyl)methoxy]butanoate IUPAC Name: 3-cyano-4-oxo-4-[(3-phenoxyphenyl)methoxy]butanoate Traditional Name: 3-cyano-4-keto-4-(3-phenoxybenzyl)oxy-butyrate Formula: C18H14NO5- MolecularWeight: 324.30746

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)COC(=O)C(CC(=O)[O-])C#N

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)COC(=O)C(CC(=O)[O-])C#N

InChI

InChI=1S/C18H15NO5/c19-11-14(10-17(20)21)18(22)23-12-13-5-4-8-16(9-13)24-15-6-2-1-3-7-15/h1-9,14H,10,12H2,(H,20,21)/p-1