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

Systemtic Name: 3-(azepan-1-ium-1-ylmethyl)-6,8-dimethoxy-2-methyl-1H-quinolin-4-one Openeye Name: 3-(azepan-1-ium-1-ylmethyl)-6,8-dimethoxy-2-methyl-1H-quinolin-4-one CAS Name: 3-(1-azepan-1-iumylmethyl)-6,8-dimethoxy-2-methyl-1H-quinolin-4-one IUPAC Name: 3-(azepan-1-ium-1-ylmethyl)-6,8-dimethoxy-2-methyl-1H-quinolin-4-one Traditional Name: 3-(azepan-1-ium-1-ylmethyl)-6,8-dimethoxy-2-methyl-4-quinolone Formula: C19H27N2O3+ MolecularWeight: 331.42928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N2O3/c1-13-16(12-21-8-6-4-5-7-9-21)19(22)15-10-14(23-2)11-17(24-3)18(15)20-13/h10-11H,4-9,12H2,1-3H3,(H,20,22)/p+1