2-cyanoethyl-[(4-pentoxyphenyl)methyl]azanium

Systemtic Name: 2-cyanoethyl-[(4-pentoxyphenyl)methyl]azanium Openeye Name: 2-cyanoethyl-[(4-pentoxyphenyl)methyl]ammonium CAS Name: 2-cyanoethyl-[(4-pentoxyphenyl)methyl]ammonium IUPAC Name: 2-cyanoethyl-[(4-pentoxyphenyl)methyl]azanium Traditional Name: (4-amoxybenzyl)-(2-cyanoethyl)ammonium Formula: C15H23N2O+ MolecularWeight: 247.35592

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C[NH2+]CCC#N

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C[NH2+]CCC#N

InChI

InChI=1S/C15H22N2O/c1-2-3-4-12-18-15-8-6-14(7-9-15)13-17-11-5-10-16/h6-9,17H,2-5,11-13H2,1H3/p+1