methyl 4,5-dimethoxy-2-[[1-[(E)-3-phenylprop-2-enoyl]piperidin-4-yl]carbonylamino]benzoate

Systemtic Name: methyl 4,5-dimethoxy-2-[[1-[(E)-3-phenylprop-2-enoyl]piperidin-4-yl]carbonylamino]benzoate Openeye Name: methyl 4,5-dimethoxy-2-[[1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carbonyl]amino]benzoate CAS Name: 4,5-dimethoxy-2-[[oxo-[1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4,5-dimethoxy-2-[[1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carbonyl]amino]benzoate Traditional Name: 4,5-dimethoxy-2-[[1-[(E)-3-phenylacryloyl]isonipecotoyl]amino]benzoic acid methyl ester Formula: C25H28N2O6 MolecularWeight: 452.49962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)C2CCN(CC2)C(=O)C=CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)C2CCN(CC2)C(=O)/C=C/C3=CC=CC=C3)OC

InChI

InChI=1S/C25H28N2O6/c1-31-21-15-19(25(30)33-3)20(16-22(21)32-2)26-24(29)18-11-13-27(14-12-18)23(28)10-9-17-7-5-4-6-8-17/h4-10,15-16,18H,11-14H2,1-3H3,(H,26,29)/b10-9+