methyl 4-[4-[2-[(2-oxidanyl-2-pyridin-3-yl-ethyl)amino]ethyl]phenyl]benzoate

Systemtic Name: methyl 4-[4-[2-[(2-oxidanyl-2-pyridin-3-yl-ethyl)amino]ethyl]phenyl]benzoate Openeye Name: methyl 4-[4-[2-[[2-hydroxy-2-(3-pyridyl)ethyl]amino]ethyl]phenyl]benzoate CAS Name: 4-[4-[2-[[2-hydroxy-2-(3-pyridinyl)ethyl]amino]ethyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-[2-[(2-hydroxy-2-pyridin-3-ylethyl)amino]ethyl]phenyl]benzoate Traditional Name: 4-[4-[2-[[2-hydroxy-2-(3-pyridyl)ethyl]amino]ethyl]phenyl]benzoic acid methyl ester Formula: C23H24N2O3 MolecularWeight: 376.44826

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)CCNCC(C3=CN=CC=C3)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)CCNCC(C3=CN=CC=C3)O

InChI

InChI=1S/C23H24N2O3/c1-28-23(27)20-10-8-19(9-11-20)18-6-4-17(5-7-18)12-14-25-16-22(26)21-3-2-13-24-15-21/h2-11,13,15,22,25-26H,12,14,16H2,1H3