3-[[4-[(E)-2-cyano-3-(methylamino)-3-oxidanylidene-prop-1-enyl]phenoxy]methyl]benzoate

Systemtic Name: 3-[[4-[(E)-2-cyano-3-(methylamino)-3-oxidanylidene-prop-1-enyl]phenoxy]methyl]benzoate Openeye Name: 3-[[4-[(E)-2-cyano-3-(methylamino)-3-oxo-prop-1-enyl]phenoxy]methyl]benzoate CAS Name: 3-[[4-[(E)-2-cyano-3-(methylamino)-3-oxoprop-1-enyl]phenoxy]methyl]benzoate IUPAC Name: 3-[[4-[(E)-2-cyano-3-(methylamino)-3-oxoprop-1-enyl]phenoxy]methyl]benzoate Traditional Name: 3-[[4-[(E)-2-cyano-3-keto-3-(methylamino)prop-1-enyl]phenoxy]methyl]benzoate Formula: C19H15N2O4- MolecularWeight: 335.3334

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C(=CC1=CC=C(C=C1)OCC2=CC=CC(=C2)C(=O)[O-])C#N

Isomeric SMILES

CNC(=O)/C(=C/C1=CC=C(C=C1)OCC2=CC=CC(=C2)C(=O)[O-])/C#N

InChI

InChI=1S/C19H16N2O4/c1-21-18(22)16(11-20)9-13-5-7-17(8-6-13)25-12-14-3-2-4-15(10-14)19(23)24/h2-10H,12H2,1H3,(H,21,22)(H,23,24)/p-1/b16-9+