2-[3-(azepan-1-ium-1-yl)propoxy]aniline

Systemtic Name: 2-[3-(azepan-1-ium-1-yl)propoxy]aniline Openeye Name: 2-[3-(azepan-1-ium-1-yl)propoxy]aniline CAS Name: 2-[3-(1-azepan-1-iumyl)propoxy]aniline IUPAC Name: 2-[3-(azepan-1-ium-1-yl)propoxy]aniline Traditional Name: [2-[3-(azepan-1-ium-1-yl)propoxy]phenyl]amine Formula: C15H25N2O+ MolecularWeight: 249.3718

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CCCOC2=CC=CC=C2N

Isomeric SMILES

C1CCC[NH+](CC1)CCCOC2=CC=CC=C2N

InChI

InChI=1S/C15H24N2O/c16-14-8-3-4-9-15(14)18-13-7-12-17-10-5-1-2-6-11-17/h3-4,8-9H,1-2,5-7,10-13,16H2/p+1