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

Systemtic Name: 2-[4-[(E)-3-(butylamino)-2-cyano-3-oxidanylidene-prop-1-enyl]phenoxy]ethanoate Openeye Name: 2-[4-[(E)-3-(butylamino)-2-cyano-3-oxo-prop-1-enyl]phenoxy]acetate CAS Name: 2-[4-[(E)-3-(butylamino)-2-cyano-3-oxoprop-1-enyl]phenoxy]acetate IUPAC Name: 2-[4-[(E)-3-(butylamino)-2-cyano-3-oxoprop-1-enyl]phenoxy]acetate Traditional Name: 2-[4-[(E)-3-(butylamino)-2-cyano-3-keto-prop-1-enyl]phenoxy]acetate Formula: C16H17N2O4- MolecularWeight: 301.31718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O4/c1-2-3-8-18-16(21)13(10-17)9-12-4-6-14(7-5-12)22-11-15(19)20/h4-7,9H,2-3,8,11H2,1H3,(H,18,21)(H,19,20)/p-1/b13-9+