(8-chloranyl-7-oxidanyl-4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-6-yl)methyl-(pyridin-4-ylmethyl)azanium

Systemtic Name: (8-chloranyl-7-oxidanyl-4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-6-yl)methyl-(pyridin-4-ylmethyl)azanium Openeye Name: (8-chloro-7-hydroxy-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-6-yl)methyl-(4-pyridylmethyl)ammonium CAS Name: (8-chloro-7-hydroxy-4-oxo-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-6-yl)methyl-(pyridin-4-ylmethyl)ammonium IUPAC Name: (8-chloro-7-hydroxy-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-6-yl)methyl-(pyridin-4-ylmethyl)azanium Traditional Name: (8-chloro-7-hydroxy-4-keto-2,3-dihydro-1H-cyclopenta[c]chromen-6-yl)methyl-(4-pyridylmethyl)ammonium Formula: C19H18ClN2O3+ MolecularWeight: 357.81082

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C(=O)OC3=C(C(=C(C=C23)Cl)O)C[NH2+]CC4=CC=NC=C4

Isomeric SMILES

C1CC2=C(C1)C(=O)OC3=C(C(=C(C=C23)Cl)O)C[NH2+]CC4=CC=NC=C4

InChI

InChI=1S/C19H17ClN2O3/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/p+1