8-chloranyl-4-oxidanylidene-6-[(pyridin-4-ylmethylazaniumyl)methyl]-2,3-dihydro-1H-cyclopenta[c]chromen-7-olate

Systemtic Name: 8-chloranyl-4-oxidanylidene-6-[(pyridin-4-ylmethylazaniumyl)methyl]-2,3-dihydro-1H-cyclopenta[c]chromen-7-olate Openeye Name: 8-chloro-4-oxo-6-[(4-pyridylmethylammonio)methyl]-2,3-dihydro-1H-cyclopenta[c]chromen-7-olate CAS Name: 8-chloro-4-oxo-6-[(pyridin-4-ylmethylammonio)methyl]-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-7-olate IUPAC Name: 8-chloro-4-oxo-6-[(pyridin-4-ylmethylazaniumyl)methyl]-2,3-dihydro-1H-cyclopenta[c]chromen-7-olate Traditional Name: 8-chloro-4-keto-6-[(4-pyridylmethylammonio)methyl]-2,3-dihydro-1H-cyclopenta[c]chromen-7-olate Formula: C19H17ClN2O3 MolecularWeight: 356.80288

Click to see the large picture

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