[[2,7-bis(fluoranyl)-10-methyl-acridin-9-ylidene]-phenylsulfanyl-methyl] dihydrogen phosphate

Systemtic Name: [[2,7-bis(fluoranyl)-10-methyl-acridin-9-ylidene]-phenylsulfanyl-methyl] dihydrogen phosphate Openeye Name: [(2,7-difluoro-10-methyl-acridin-9-ylidene)-phenylsulfanyl-methyl] dihydrogen phosphate CAS Name: [(2,7-difluoro-10-methyl-9-acridinylidene)-(phenylthio)methyl] dihydrogen phosphate IUPAC Name: [(2,7-difluoro-10-methylacridin-9-ylidene)-phenylsulfanylmethyl] dihydrogen phosphate Traditional Name: [(2,7-difluoro-10-methyl-acridin-9-ylidene)-(phenylthio)methyl] dihydrogen phosphate Formula: C21H16F2NO4PS MolecularWeight: 447.391607

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)F)C(=C(OP(=O)(O)O)SC3=CC=CC=C3)C4=C1C=CC(=C4)F

Isomeric SMILES

CN1C2=C(C=C(C=C2)F)C(=C(OP(=O)(O)O)SC3=CC=CC=C3)C4=C1C=CC(=C4)F

InChI

InChI=1S/C21H16F2NO4PS/c1-24-18-9-7-13(22)11-16(18)20(17-12-14(23)8-10-19(17)24)21(28-29(25,26)27)30-15-5-3-2-4-6-15/h2-12H,1H3,(H2,25,26,27)