methyl 4-[[phenethyl(3-phenylpropyl)amino]methyl]benzoate

Systemtic Name: methyl 4-[[phenethyl(3-phenylpropyl)amino]methyl]benzoate Openeye Name: methyl 4-[[phenethyl(3-phenylpropyl)amino]methyl]benzoate CAS Name: 4-[[phenethyl(3-phenylpropyl)amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[phenethyl(3-phenylpropyl)amino]methyl]benzoate Traditional Name: 4-[[phenethyl(3-phenylpropyl)amino]methyl]benzoic acid methyl ester Formula: C26H29NO2 MolecularWeight: 387.51396

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN(CCCC2=CC=CC=C2)CCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN(CCCC2=CC=CC=C2)CCC3=CC=CC=C3

InChI

InChI=1S/C26H29NO2/c1-29-26(28)25-16-14-24(15-17-25)21-27(20-18-23-11-6-3-7-12-23)19-8-13-22-9-4-2-5-10-22/h2-7,9-12,14-17H,8,13,18-21H2,1H3