methyl 4-[[butyl(phenethyl)amino]methyl]benzoate

Systemtic Name: methyl 4-[[butyl(phenethyl)amino]methyl]benzoate Openeye Name: methyl 4-[[butyl(phenethyl)amino]methyl]benzoate CAS Name: 4-[[butyl(phenethyl)amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[butyl(phenethyl)amino]methyl]benzoate Traditional Name: 4-[[butyl(phenethyl)amino]methyl]benzoic acid methyl ester Formula: C21H27NO2 MolecularWeight: 325.44458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCC1=CC=CC=C1)CC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CCCCN(CCC1=CC=CC=C1)CC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C21H27NO2/c1-3-4-15-22(16-14-18-8-6-5-7-9-18)17-19-10-12-20(13-11-19)21(23)24-2/h5-13H,3-4,14-17H2,1-2H3