ethyl 3-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]carbonylamino]benzoate

Systemtic Name: ethyl 3-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]carbonylamino]benzoate Openeye Name: ethyl 3-[[4-[(E)-cinnamyl]piperazine-1-carbonyl]amino]benzoate CAS Name: 3-[[oxo-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbonyl]amino]benzoate Traditional Name: 3-[[4-[(E)-cinnamyl]piperazine-1-carbonyl]amino]benzoic acid ethyl ester Formula: C23H27N3O3 MolecularWeight: 393.47878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)N2CCN(CC2)CC=CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)N2CCN(CC2)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C23H27N3O3/c1-2-29-22(27)20-11-6-12-21(18-20)24-23(28)26-16-14-25(15-17-26)13-7-10-19-8-4-3-5-9-19/h3-12,18H,2,13-17H2,1H3,(H,24,28)/b10-7+