methyl 2-[2-(4-phenylpiperazin-1-yl)ethyl-(pyridin-2-ylmethyl)amino]benzoate

Systemtic Name: methyl 2-[2-(4-phenylpiperazin-1-yl)ethyl-(pyridin-2-ylmethyl)amino]benzoate Openeye Name: methyl 2-[2-(4-phenylpiperazin-1-yl)ethyl-(2-pyridylmethyl)amino]benzoate CAS Name: 2-[2-(4-phenyl-1-piperazinyl)ethyl-(2-pyridinylmethyl)amino]benzoic acid methyl ester IUPAC Name: methyl 2-[2-(4-phenylpiperazin-1-yl)ethyl-(pyridin-2-ylmethyl)amino]benzoate Traditional Name: 2-[2-(4-phenylpiperazino)ethyl-(2-pyridylmethyl)amino]benzoic acid methyl ester Formula: C26H30N4O2 MolecularWeight: 430.542

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1N(CCN2CCN(CC2)C3=CC=CC=C3)CC4=CC=CC=N4

Isomeric SMILES

COC(=O)C1=CC=CC=C1N(CCN2CCN(CC2)C3=CC=CC=C3)CC4=CC=CC=N4

InChI

InChI=1S/C26H30N4O2/c1-32-26(31)24-12-5-6-13-25(24)30(21-22-9-7-8-14-27-22)20-17-28-15-18-29(19-16-28)23-10-3-2-4-11-23/h2-14H,15-21H2,1H3