methyl 4-[[(4-cyanophenyl)methyl-(oxolan-2-ylmethyl)amino]methyl]benzoate

Systemtic Name: methyl 4-[[(4-cyanophenyl)methyl-(oxolan-2-ylmethyl)amino]methyl]benzoate Openeye Name: methyl 4-[[(4-cyanophenyl)methyl-(tetrahydrofuran-2-ylmethyl)amino]methyl]benzoate CAS Name: 4-[[(4-cyanophenyl)methyl-(2-oxolanylmethyl)amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(4-cyanophenyl)methyl-(oxolan-2-ylmethyl)amino]methyl]benzoate Traditional Name: 4-[[(4-cyanobenzyl)-(tetrahydrofurfuryl)amino]methyl]benzoic acid methyl ester Formula: C22H24N2O3 MolecularWeight: 364.43756

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN(CC2CCCO2)CC3=CC=C(C=C3)C#N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN(CC2CCCO2)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H24N2O3/c1-26-22(25)20-10-8-19(9-11-20)15-24(16-21-3-2-12-27-21)14-18-6-4-17(13-23)5-7-18/h4-11,21H,2-3,12,14-16H2,1H3