6-chloranyl-4-phenyl-9-(pyridin-3-ylmethyl)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one

Systemtic Name: 6-chloranyl-4-phenyl-9-(pyridin-3-ylmethyl)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one Openeye Name: 6-chloro-4-phenyl-9-(3-pyridylmethyl)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one CAS Name: 6-chloro-4-phenyl-9-(3-pyridinylmethyl)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one IUPAC Name: 6-chloro-4-phenyl-9-(pyridin-3-ylmethyl)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one Traditional Name: 6-chloro-4-phenyl-9-(3-pyridylmethyl)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one Formula: C23H18ClN2O3+ MolecularWeight: 405.85362

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C3C(=CC(=C2OC[NH+]1CC4=CN=CC=C4)Cl)C(=CC(=O)O3)C5=CC=CC=C5

Isomeric SMILES

C1C2=C3C(=CC(=C2OC[NH+]1CC4=CN=CC=C4)Cl)C(=CC(=O)O3)C5=CC=CC=C5

InChI

InChI=1S/C23H17ClN2O3/c24-20-9-18-17(16-6-2-1-3-7-16)10-21(27)29-22(18)19-13-26(14-28-23(19)20)12-15-5-4-8-25-11-15/h1-11H,12-14H2/p+1