methyl 5-[[4-[(E)-2-cyano-3-oxidanylidene-3-(propan-2-ylamino)prop-1-enyl]-2-methoxy-phenoxy]methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[4-[(E)-2-cyano-3-oxidanylidene-3-(propan-2-ylamino)prop-1-enyl]-2-methoxy-phenoxy]methyl]furan-2-carboxylate Openeye Name: methyl 5-[[4-[(E)-2-cyano-3-(isopropylamino)-3-oxo-prop-1-enyl]-2-methoxy-phenoxy]methyl]furan-2-carboxylate CAS Name: 5-[[4-[(E)-2-cyano-3-oxo-3-(propan-2-ylamino)prop-1-enyl]-2-methoxyphenoxy]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-[(E)-2-cyano-3-oxo-3-(propan-2-ylamino)prop-1-enyl]-2-methoxyphenoxy]methyl]furan-2-carboxylate Traditional Name: 5-[[4-[(E)-2-cyano-3-(isopropylamino)-3-keto-prop-1-enyl]-2-methoxy-phenoxy]methyl]furan-2-carboxylic acid methyl ester Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(=CC1=CC(=C(C=C1)OCC2=CC=C(O2)C(=O)OC)OC)C#N

Isomeric SMILES

CC(C)NC(=O)/C(=C/C1=CC(=C(C=C1)OCC2=CC=C(O2)C(=O)OC)OC)/C#N

InChI

InChI=1S/C21H22N2O6/c1-13(2)23-20(24)15(11-22)9-14-5-7-17(19(10-14)26-3)28-12-16-6-8-18(29-16)21(25)27-4/h5-10,13H,12H2,1-4H3,(H,23,24)/b15-9+