8-chloranyl-7-oxidanyl-6-[(pyridin-4-ylmethylamino)methyl]-2,3-dihydro-1H-cyclopenta[c]chromen-4-one dihydrochloride

Systemtic Name: 8-chloranyl-7-oxidanyl-6-[(pyridin-4-ylmethylamino)methyl]-2,3-dihydro-1H-cyclopenta[c]chromen-4-one dihydrochloride Openeye Name: 8-chloro-7-hydroxy-6-[(4-pyridylmethylamino)methyl]-2,3-dihydro-1H-cyclopenta[c]chromen-4-one dihydrochloride CAS Name: 8-chloro-7-hydroxy-6-[(pyridin-4-ylmethylamino)methyl]-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-4-one dihydrochloride IUPAC Name: 8-chloro-7-hydroxy-6-[(pyridin-4-ylmethylamino)methyl]-2,3-dihydro-1H-cyclopenta[c]chromen-4-one dihydrochloride Traditional Name: 8-chloro-7-hydroxy-6-[(4-pyridylmethylamino)methyl]-2,3-dihydro-1H-cyclopenta[c]chromen-4-one dihydrochloride Formula: C19H19Cl3N2O3 MolecularWeight: 429.72476

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C(=O)OC3=C(C(=C(C=C23)Cl)O)CNCC4=CC=NC=C4.Cl.Cl

Isomeric SMILES

C1CC2=C(C1)C(=O)OC3=C(C(=C(C=C23)Cl)O)CNCC4=CC=NC=C4.Cl.Cl

InChI

InChI=1S/C19H17ClN2O3.2ClH/c20-16-8-14-12-2-1-3-13(12)19(24)25-18(14)15(17(16)23)10-22-9-11-4-6-21-7-5-11;;/h4-8,22-23H,1-3,9-10H2;2*1H