N-[(4-butoxyphenyl)methyl]-1-pyridin-3-yl-ethanamine

Systemtic Name: N-[(4-butoxyphenyl)methyl]-1-pyridin-3-yl-ethanamine Openeye Name: N-[(4-butoxyphenyl)methyl]-1-(3-pyridyl)ethanamine CAS Name: N-[(4-butoxyphenyl)methyl]-1-(3-pyridinyl)ethanamine IUPAC Name: N-[(4-butoxyphenyl)methyl]-1-pyridin-3-ylethanamine Traditional Name: (4-butoxybenzyl)-[1-(3-pyridyl)ethyl]amine Formula: C18H24N2O MolecularWeight: 284.39596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CNC(C)C2=CN=CC=C2

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CNC(C)C2=CN=CC=C2

InChI

InChI=1S/C18H24N2O/c1-3-4-12-21-18-9-7-16(8-10-18)13-20-15(2)17-6-5-11-19-14-17/h5-11,14-15,20H,3-4,12-13H2,1-2H3