2-[2-chloranyl-4-[(Z)-2-cyano-3-oxidanylidene-3-[(phenylmethyl)amino]prop-1-enyl]-6-methoxy-phenoxy]ethanoate

Systemtic Name: 2-[2-chloranyl-4-[(Z)-2-cyano-3-oxidanylidene-3-[(phenylmethyl)amino]prop-1-enyl]-6-methoxy-phenoxy]ethanoate Openeye Name: 2-[4-[(Z)-3-(benzylamino)-2-cyano-3-oxo-prop-1-enyl]-2-chloro-6-methoxy-phenoxy]acetate CAS Name: 2-[2-chloro-4-[(Z)-2-cyano-3-oxo-3-[(phenylmethyl)amino]prop-1-enyl]-6-methoxyphenoxy]acetate IUPAC Name: 2-[4-[(Z)-3-(benzylamino)-2-cyano-3-oxoprop-1-enyl]-2-chloro-6-methoxyphenoxy]acetate Traditional Name: 2-[4-[(Z)-3-(benzylamino)-2-cyano-3-keto-prop-1-enyl]-2-chloro-6-methoxy-phenoxy]acetate Formula: C20H16ClN2O5- MolecularWeight: 399.80444

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C(C#N)C(=O)NCC2=CC=CC=C2)Cl)OCC(=O)[O-]

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C(/C#N)\C(=O)NCC2=CC=CC=C2)Cl)OCC(=O)[O-]

InChI

InChI=1S/C20H17ClN2O5/c1-27-17-9-14(8-16(21)19(17)28-12-18(24)25)7-15(10-22)20(26)23-11-13-5-3-2-4-6-13/h2-9H,11-12H2,1H3,(H,23,26)(H,24,25)/p-1/b15-7-