4-(azepan-1-ium-1-ylmethyl)-2-chloranyl-6,8-dimethyl-quinoline

Systemtic Name: 4-(azepan-1-ium-1-ylmethyl)-2-chloranyl-6,8-dimethyl-quinoline Openeye Name: 4-(azepan-1-ium-1-ylmethyl)-2-chloro-6,8-dimethyl-quinoline CAS Name: 4-(1-azepan-1-iumylmethyl)-2-chloro-6,8-dimethylquinoline IUPAC Name: 4-(azepan-1-ium-1-ylmethyl)-2-chloro-6,8-dimethylquinoline Traditional Name: 4-(azepan-1-ium-1-ylmethyl)-2-chloro-6,8-dimethyl-quinoline Formula: C18H24ClN2+ MolecularWeight: 303.84956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)Cl)C[NH+]3CCCCCC3)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)Cl)C[NH+]3CCCCCC3)C

InChI

InChI=1S/C18H23ClN2/c1-13-9-14(2)18-16(10-13)15(11-17(19)20-18)12-21-7-5-3-4-6-8-21/h9-11H,3-8,12H2,1-2H3/p+1