3-(azepan-1-ium-1-ylmethyl)-6-chloranyl-2,8-dimethyl-1H-quinolin-4-one

Systemtic Name: 3-(azepan-1-ium-1-ylmethyl)-6-chloranyl-2,8-dimethyl-1H-quinolin-4-one Openeye Name: 3-(azepan-1-ium-1-ylmethyl)-6-chloro-2,8-dimethyl-1H-quinolin-4-one CAS Name: 3-(1-azepan-1-iumylmethyl)-6-chloro-2,8-dimethyl-1H-quinolin-4-one IUPAC Name: 3-(azepan-1-ium-1-ylmethyl)-6-chloro-2,8-dimethyl-1H-quinolin-4-one Traditional Name: 3-(azepan-1-ium-1-ylmethyl)-6-chloro-2,8-dimethyl-4-quinolone Formula: C18H24ClN2O+ MolecularWeight: 319.84896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23ClN2O/c1-12-9-14(19)10-15-17(12)20-13(2)16(18(15)22)11-21-7-5-3-4-6-8-21/h9-10H,3-8,11H2,1-2H3,(H,20,22)/p+1