methyl 4-[[4-[2-(1H-imidazol-5-yl)ethylamino]piperidin-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[4-[2-(1H-imidazol-5-yl)ethylamino]piperidin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[4-[2-(1H-imidazol-5-yl)ethylamino]-1-piperidyl]methyl]benzoate CAS Name: 4-[[4-[2-(1H-imidazol-5-yl)ethylamino]-1-piperidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-[2-(1H-imidazol-5-yl)ethylamino]piperidin-1-yl]methyl]benzoate Traditional Name: 4-[[4-[2-(1H-imidazol-5-yl)ethylamino]piperidino]methyl]benzoic acid methyl ester Formula: C19H26N4O2 MolecularWeight: 342.43534

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN2CCC(CC2)NCCC3=CN=CN3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN2CCC(CC2)NCCC3=CN=CN3

InChI

InChI=1S/C19H26N4O2/c1-25-19(24)16-4-2-15(3-5-16)13-23-10-7-17(8-11-23)21-9-6-18-12-20-14-22-18/h2-5,12,14,17,21H,6-11,13H2,1H3,(H,20,22)