3-(4-chlorophenyl)-9-cyclopentyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one

Systemtic Name: 3-(4-chlorophenyl)-9-cyclopentyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Openeye Name: 3-(4-chlorophenyl)-9-cyclopentyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one CAS Name: 3-(4-chlorophenyl)-9-cyclopentyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one IUPAC Name: 3-(4-chlorophenyl)-9-cyclopentyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Traditional Name: 3-(4-chlorophenyl)-9-cyclopentyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Formula: C22H21ClNO3+ MolecularWeight: 382.86004

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CC3=C(C=CC4=C3OC=C(C4=O)C5=CC=C(C=C5)Cl)OC2

Isomeric SMILES

C1CCC(C1)[NH+]2CC3=C(C=CC4=C3OC=C(C4=O)C5=CC=C(C=C5)Cl)OC2

InChI

InChI=1S/C22H20ClNO3/c23-15-7-5-14(6-8-15)19-12-26-22-17(21(19)25)9-10-20-18(22)11-24(13-27-20)16-3-1-2-4-16/h5-10,12,16H,1-4,11,13H2/p+1