[4-[[(E)-2-ethoxycarbonyl-3-oxidanylidene-hex-1-enyl]amino]phenyl]methyl benzoate

Systemtic Name: [4-[[(E)-2-ethoxycarbonyl-3-oxidanylidene-hex-1-enyl]amino]phenyl]methyl benzoate Openeye Name: [4-[[(E)-2-ethoxycarbonyl-3-oxo-hex-1-enyl]amino]phenyl]methyl benzoate CAS Name: benzoic acid [4-[[(E)-2-ethoxycarbonyl-3-oxohex-1-enyl]amino]phenyl]methyl ester IUPAC Name: [4-[[(E)-2-ethoxycarbonyl-3-oxohex-1-enyl]amino]phenyl]methyl benzoate Traditional Name: benzoic acid [4-[[(E)-2-carbethoxy-3-keto-hex-1-enyl]amino]benzyl] ester Formula: C23H25NO5 MolecularWeight: 395.4483

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C(=CNC1=CC=C(C=C1)COC(=O)C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCCC(=O)/C(=C\NC1=CC=C(C=C1)COC(=O)C2=CC=CC=C2)/C(=O)OCC

InChI

InChI=1S/C23H25NO5/c1-3-8-21(25)20(23(27)28-4-2)15-24-19-13-11-17(12-14-19)16-29-22(26)18-9-6-5-7-10-18/h5-7,9-15,24H,3-4,8,16H2,1-2H3/b20-15+