8-chloranyl-4-oxidanylidene-6-(piperidin-1-ium-1-ylmethyl)-2,3-dihydro-1H-cyclopenta[c]chromen-7-olate

Systemtic Name: 8-chloranyl-4-oxidanylidene-6-(piperidin-1-ium-1-ylmethyl)-2,3-dihydro-1H-cyclopenta[c]chromen-7-olate Openeye Name: 8-chloro-4-oxo-6-(piperidin-1-ium-1-ylmethyl)-2,3-dihydro-1H-cyclopenta[c]chromen-7-olate CAS Name: 8-chloro-4-oxo-6-(1-piperidin-1-iumylmethyl)-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-7-olate IUPAC Name: 8-chloro-4-oxo-6-(piperidin-1-ium-1-ylmethyl)-2,3-dihydro-1H-cyclopenta[c]chromen-7-olate Traditional Name: 8-chloro-4-keto-6-(piperidin-1-ium-1-ylmethyl)-2,3-dihydro-1H-cyclopenta[c]chromen-7-olate Formula: C18H20ClNO3 MolecularWeight: 333.8093

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=C3C(=CC(=C2[O-])Cl)C4=C(CCC4)C(=O)O3

Isomeric SMILES

C1CC[NH+](CC1)CC2=C3C(=CC(=C2[O-])Cl)C4=C(CCC4)C(=O)O3

InChI

InChI=1S/C18H20ClNO3/c19-15-9-13-11-5-4-6-12(11)18(22)23-17(13)14(16(15)21)10-20-7-2-1-3-8-20/h9,21H,1-8,10H2