2-(azepan-1-yl)-4-methyl-quinolin-1-ium

Systemtic Name: 2-(azepan-1-yl)-4-methyl-quinolin-1-ium Openeye Name: 2-(azepan-1-yl)-4-methyl-quinolin-1-ium CAS Name: 2-(1-azepanyl)-4-methylquinolin-1-ium IUPAC Name: 2-(azepan-1-yl)-4-methylquinolin-1-ium Traditional Name: 2-(azepan-1-yl)-4-methyl-quinolin-1-ium Formula: C16H21N2+ MolecularWeight: 241.35134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C2=CC=CC=C12)N3CCCCCC3

Isomeric SMILES

CC1=CC(=[NH+]C2=CC=CC=C12)N3CCCCCC3

InChI

InChI=1S/C16H20N2/c1-13-12-16(18-10-6-2-3-7-11-18)17-15-9-5-4-8-14(13)15/h4-5,8-9,12H,2-3,6-7,10-11H2,1H3/p+1