(4-butoxyphenyl)methyl-(3-imidazol-1-ylpropyl)azanium

Systemtic Name: (4-butoxyphenyl)methyl-(3-imidazol-1-ylpropyl)azanium Openeye Name: (4-butoxyphenyl)methyl-(3-imidazol-1-ylpropyl)ammonium CAS Name: (4-butoxyphenyl)methyl-[3-(1-imidazolyl)propyl]ammonium IUPAC Name: (4-butoxyphenyl)methyl-(3-imidazol-1-ylpropyl)azanium Traditional Name: (4-butoxybenzyl)-(3-imidazol-1-ylpropyl)ammonium Formula: C17H26N3O+ MolecularWeight: 288.40784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C[NH2+]CCCN2C=CN=C2

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C[NH2+]CCCN2C=CN=C2

InChI

InChI=1S/C17H25N3O/c1-2-3-13-21-17-7-5-16(6-8-17)14-18-9-4-11-20-12-10-19-15-20/h5-8,10,12,15,18H,2-4,9,11,13-14H2,1H3/p+1