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

Systemtic Name: 8-chloranyl-4-oxidanylidene-6-[(pyridin-1-ium-2-ylamino)methyl]-2,3-dihydro-1H-cyclopenta[c]chromen-7-olate Openeye Name: 8-chloro-4-oxo-6-[(pyridin-1-ium-2-ylamino)methyl]-2,3-dihydro-1H-cyclopenta[c]chromen-7-olate CAS Name: 8-chloro-4-oxo-6-[(2-pyridin-1-iumylamino)methyl]-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-7-olate IUPAC Name: 8-chloro-4-oxo-6-[(pyridin-1-ium-2-ylamino)methyl]-2,3-dihydro-1H-cyclopenta[c]chromen-7-olate Traditional Name: 8-chloro-4-keto-6-[(pyridin-1-ium-2-ylamino)methyl]-2,3-dihydro-1H-cyclopenta[c]chromen-7-olate Formula: C18H15ClN2O3 MolecularWeight: 342.7763

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C(=O)OC3=C(C(=C(C=C23)Cl)[O-])CNC4=CC=CC=[NH+]4

Isomeric SMILES

C1CC2=C(C1)C(=O)OC3=C(C(=C(C=C23)Cl)[O-])CNC4=CC=CC=[NH+]4

InChI

InChI=1S/C18H15ClN2O3/c19-14-8-12-10-4-3-5-11(10)18(23)24-17(12)13(16(14)22)9-21-15-6-1-2-7-20-15/h1-2,6-8,22H,3-5,9H2,(H,20,21)