1-(1-phenethylpiperidin-4-yl)azepan-1-ium

Systemtic Name: 1-(1-phenethylpiperidin-4-yl)azepan-1-ium Openeye Name: 1-(1-phenethyl-4-piperidyl)azepan-1-ium CAS Name: 1-(1-phenethyl-4-piperidinyl)azepan-1-ium IUPAC Name: 1-(1-phenethylpiperidin-4-yl)azepan-1-ium Traditional Name: 1-(1-phenethyl-4-piperidyl)azepan-1-ium Formula: C19H31N2+ MolecularWeight: 287.46284

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)C2CCN(CC2)CCC3=CC=CC=C3

Isomeric SMILES

C1CCC[NH+](CC1)C2CCN(CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C19H30N2/c1-2-7-14-21(13-6-1)19-11-16-20(17-12-19)15-10-18-8-4-3-5-9-18/h3-5,8-9,19H,1-2,6-7,10-17H2/p+1