6-methoxy-2-methyl-3-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]quinazolin-4-one

Systemtic Name: 6-methoxy-2-methyl-3-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]quinazolin-4-one Openeye Name: 6-methoxy-2-methyl-3-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]quinazolin-4-one CAS Name: 6-methoxy-2-methyl-3-[[(3S)-3-methyl-1-piperidin-1-iumyl]methyl]-4-quinazolinone IUPAC Name: 6-methoxy-2-methyl-3-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]quinazolin-4-one Traditional Name: 6-methoxy-2-methyl-3-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]quinazolin-4-one Formula: C17H24N3O2+ MolecularWeight: 302.39136

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CN2C(=NC3=C(C2=O)C=C(C=C3)OC)C

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CN2C(=NC3=C(C2=O)C=C(C=C3)OC)C

InChI

InChI=1S/C17H23N3O2/c1-12-5-4-8-19(10-12)11-20-13(2)18-16-7-6-14(22-3)9-15(16)17(20)21/h6-7,9,12H,4-5,8,10-11H2,1-3H3/p+1/t12-/m0/s1