methyl 4-[[3-phenylprop-2-enyl(3-phenylpropyl)amino]methyl]benzoate

Systemtic Name: methyl 4-[[3-phenylprop-2-enyl(3-phenylpropyl)amino]methyl]benzoate Openeye Name: methyl 4-[[cinnamyl(3-phenylpropyl)amino]methyl]benzoate CAS Name: 4-[[3-phenylprop-2-enyl(3-phenylpropyl)amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-phenylprop-2-enyl(3-phenylpropyl)amino]methyl]benzoate Traditional Name: 4-[[cinnamyl(3-phenylpropyl)amino]methyl]benzoic acid methyl ester Formula: C27H29NO2 MolecularWeight: 399.52466

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN(CCCC2=CC=CC=C2)CC=CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN(CCCC2=CC=CC=C2)CC=CC3=CC=CC=C3

InChI

InChI=1S/C27H29NO2/c1-30-27(29)26-18-16-25(17-19-26)22-28(20-8-14-23-10-4-2-5-11-23)21-9-15-24-12-6-3-7-13-24/h2-8,10-14,16-19H,9,15,20-22H2,1H3