2,2-dimethyl-7-(3-piperidin-1-ium-1-ylpropoxy)-3H-chromen-4-one

Systemtic Name: 2,2-dimethyl-7-(3-piperidin-1-ium-1-ylpropoxy)-3H-chromen-4-one Openeye Name: 2,2-dimethyl-7-(3-piperidin-1-ium-1-ylpropoxy)chroman-4-one CAS Name: 2,2-dimethyl-7-[3-(1-piperidin-1-iumyl)propoxy]-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 2,2-dimethyl-7-(3-piperidin-1-ium-1-ylpropoxy)-3H-chromen-4-one Traditional Name: 2,2-dimethyl-7-(3-piperidin-1-ium-1-ylpropoxy)chroman-4-one Formula: C19H28NO3+ MolecularWeight: 318.43052

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2=C(O1)C=C(C=C2)OCCC[NH+]3CCCCC3)C

Isomeric SMILES

CC1(CC(=O)C2=C(O1)C=C(C=C2)OCCC[NH+]3CCCCC3)C

InChI

InChI=1S/C19H27NO3/c1-19(2)14-17(21)16-8-7-15(13-18(16)23-19)22-12-6-11-20-9-4-3-5-10-20/h7-8,13H,3-6,9-12,14H2,1-2H3/p+1