[2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]carbonylphenyl]methyl benzoate

Systemtic Name: [2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]carbonylphenyl]methyl benzoate Openeye Name: [2-[4-[(E)-cinnamyl]piperazine-1-carbonyl]phenyl]methyl benzoate CAS Name: benzoic acid [2-[oxo-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]methyl]phenyl]methyl ester IUPAC Name: [2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbonyl]phenyl]methyl benzoate Traditional Name: benzoic acid [2-[4-[(E)-cinnamyl]piperazine-1-carbonyl]benzyl] ester Formula: C28H28N2O3 MolecularWeight: 440.53352

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC=CC2=CC=CC=C2)C(=O)C3=CC=CC=C3COC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C/C=C/C2=CC=CC=C2)C(=O)C3=CC=CC=C3COC(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H28N2O3/c31-27(30-20-18-29(19-21-30)17-9-12-23-10-3-1-4-11-23)26-16-8-7-15-25(26)22-33-28(32)24-13-5-2-6-14-24/h1-16H,17-22H2/b12-9+