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

Systemtic Name: methyl 4-[[[1-[(E)-3-phenylprop-2-enoyl]piperidin-4-yl]carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[[1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carbonyl]amino]methyl]benzoate CAS Name: 4-[[[oxo-[1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinyl]methyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carbonyl]amino]methyl]benzoate Traditional Name: 4-[[[1-[(E)-3-phenylacryloyl]isonipecotoyl]amino]methyl]benzoic acid methyl ester Formula: C24H26N2O4 MolecularWeight: 406.47424

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)C2CCN(CC2)C(=O)C=CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)C2CCN(CC2)C(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C24H26N2O4/c1-30-24(29)21-10-7-19(8-11-21)17-25-23(28)20-13-15-26(16-14-20)22(27)12-9-18-5-3-2-4-6-18/h2-12,20H,13-17H2,1H3,(H,25,28)/b12-9+