3-(azepan-1-ium-1-ylmethyl)-5-chloranyl-8-methoxy-2-methyl-1H-quinolin-4-one

Systemtic Name: 3-(azepan-1-ium-1-ylmethyl)-5-chloranyl-8-methoxy-2-methyl-1H-quinolin-4-one Openeye Name: 3-(azepan-1-ium-1-ylmethyl)-5-chloro-8-methoxy-2-methyl-1H-quinolin-4-one CAS Name: 3-(1-azepan-1-iumylmethyl)-5-chloro-8-methoxy-2-methyl-1H-quinolin-4-one IUPAC Name: 3-(azepan-1-ium-1-ylmethyl)-5-chloro-8-methoxy-2-methyl-1H-quinolin-4-one Traditional Name: 3-(azepan-1-ium-1-ylmethyl)-5-chloro-8-methoxy-2-methyl-4-quinolone Formula: C18H24ClN2O2+ MolecularWeight: 335.84836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(C=CC(=C2N1)OC)Cl)C[NH+]3CCCCCC3

Isomeric SMILES

CC1=C(C(=O)C2=C(C=CC(=C2N1)OC)Cl)C[NH+]3CCCCCC3

InChI

InChI=1S/C18H23ClN2O2/c1-12-13(11-21-9-5-3-4-6-10-21)18(22)16-14(19)7-8-15(23-2)17(16)20-12/h7-8H,3-6,9-11H2,1-2H3,(H,20,22)/p+1