2-methyl-3-(piperidin-1-ium-1-ylmethyl)-1H-quinolin-4-one

Systemtic Name: 2-methyl-3-(piperidin-1-ium-1-ylmethyl)-1H-quinolin-4-one Openeye Name: 2-methyl-3-(piperidin-1-ium-1-ylmethyl)-1H-quinolin-4-one CAS Name: 2-methyl-3-(1-piperidin-1-iumylmethyl)-1H-quinolin-4-one IUPAC Name: 2-methyl-3-(piperidin-1-ium-1-ylmethyl)-1H-quinolin-4-one Traditional Name: 2-methyl-3-(piperidin-1-ium-1-ylmethyl)-4-quinolone Formula: C16H21N2O+ MolecularWeight: 257.35074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=CC=CC=C2N1)C[NH+]3CCCCC3

Isomeric SMILES

CC1=C(C(=O)C2=CC=CC=C2N1)C[NH+]3CCCCC3

InChI

InChI=1S/C16H20N2O/c1-12-14(11-18-9-5-2-6-10-18)16(19)13-7-3-4-8-15(13)17-12/h3-4,7-8H,2,5-6,9-11H2,1H3,(H,17,19)/p+1