2-[4-[(E)-2-cyano-3-(3-methoxypropylamino)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenoxy]ethanoate

Systemtic Name: 2-[4-[(E)-2-cyano-3-(3-methoxypropylamino)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenoxy]ethanoate Openeye Name: 2-[4-[(E)-2-cyano-3-(3-methoxypropylamino)-3-oxo-prop-1-enyl]-2-methoxy-phenoxy]acetate CAS Name: 2-[4-[(E)-2-cyano-3-(3-methoxypropylamino)-3-oxoprop-1-enyl]-2-methoxyphenoxy]acetate IUPAC Name: 2-[4-[(E)-2-cyano-3-(3-methoxypropylamino)-3-oxoprop-1-enyl]-2-methoxyphenoxy]acetate Traditional Name: 2-[4-[(E)-2-cyano-3-keto-3-(3-methoxypropylamino)prop-1-enyl]-2-methoxy-phenoxy]acetate Formula: C17H19N2O6- MolecularWeight: 347.34256

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)C(=CC1=CC(=C(C=C1)OCC(=O)[O-])OC)C#N

Isomeric SMILES

COCCCNC(=O)/C(=C/C1=CC(=C(C=C1)OCC(=O)[O-])OC)/C#N

InChI

InChI=1S/C17H20N2O6/c1-23-7-3-6-19-17(22)13(10-18)8-12-4-5-14(15(9-12)24-2)25-11-16(20)21/h4-5,8-9H,3,6-7,11H2,1-2H3,(H,19,22)(H,20,21)/p-1/b13-8+