methyl 4-[(4-phenethylpiperazin-1-yl)methyl]benzoate

Systemtic Name: methyl 4-[(4-phenethylpiperazin-1-yl)methyl]benzoate Openeye Name: methyl 4-[(4-phenethylpiperazin-1-yl)methyl]benzoate CAS Name: 4-[(4-phenethyl-1-piperazinyl)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(4-phenethylpiperazin-1-yl)methyl]benzoate Traditional Name: 4-[(4-phenethylpiperazino)methyl]benzoic acid methyl ester Formula: C21H26N2O2 MolecularWeight: 338.44334

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN2CCN(CC2)CCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN2CCN(CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O2/c1-25-21(24)20-9-7-19(8-10-20)17-23-15-13-22(14-16-23)12-11-18-5-3-2-4-6-18/h2-10H,11-17H2,1H3