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

Systemtic Name: 2-[4-[(E)-2-cyano-3-(3-methoxypropylamino)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenoxy]ethanoic acid Openeye Name: 2-[4-[(E)-2-cyano-3-(3-methoxypropylamino)-3-oxo-prop-1-enyl]-2-methoxy-phenoxy]acetic acid CAS Name: 2-[4-[(E)-2-cyano-3-(3-methoxypropylamino)-3-oxoprop-1-enyl]-2-methoxyphenoxy]acetic acid IUPAC Name: 2-[4-[(E)-2-cyano-3-(3-methoxypropylamino)-3-oxoprop-1-enyl]-2-methoxyphenoxy]acetic acid Traditional Name: 2-[4-[(E)-2-cyano-3-keto-3-(3-methoxypropylamino)prop-1-enyl]-2-methoxy-phenoxy]acetic acid Formula: C17H20N2O6 MolecularWeight: 348.3505

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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)/b13-8+