8-methyl-2-oxidanylidene-6-(piperidin-1-ium-1-ylmethyl)-4-propyl-chromen-7-olate

Systemtic Name: 8-methyl-2-oxidanylidene-6-(piperidin-1-ium-1-ylmethyl)-4-propyl-chromen-7-olate Openeye Name: 8-methyl-2-oxo-6-(piperidin-1-ium-1-ylmethyl)-4-propyl-chromen-7-olate CAS Name: 8-methyl-2-oxo-6-(1-piperidin-1-iumylmethyl)-4-propyl-1-benzopyran-7-olate IUPAC Name: 8-methyl-2-oxo-6-(piperidin-1-ium-1-ylmethyl)-4-propylchromen-7-olate Traditional Name: 2-keto-8-methyl-6-(piperidin-1-ium-1-ylmethyl)-4-propyl-chromen-7-olate Formula: C19H25NO3 MolecularWeight: 315.4067

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C(C(=C(C=C12)C[NH+]3CCCCC3)[O-])C

Isomeric SMILES

CCCC1=CC(=O)OC2=C(C(=C(C=C12)C[NH+]3CCCCC3)[O-])C

InChI

InChI=1S/C19H25NO3/c1-3-7-14-11-17(21)23-19-13(2)18(22)15(10-16(14)19)12-20-8-5-4-6-9-20/h10-11,22H,3-9,12H2,1-2H3