[(10-methylacridin-9-ylidene)-phenylsulfanyl-methyl] dihydrogen phosphate; yttrium

Systemtic Name: [(10-methylacridin-9-ylidene)-phenylsulfanyl-methyl] dihydrogen phosphate; yttrium Openeye Name: [(10-methylacridin-9-ylidene)-phenylsulfanyl-methyl] dihydrogen phosphate; yttrium CAS Name: [(10-methyl-9-acridinylidene)-(phenylthio)methyl] dihydrogen phosphate; yttrium IUPAC Name: [(10-methylacridin-9-ylidene)-phenylsulfanylmethyl] dihydrogen phosphate; yttrium Traditional Name: [(10-methylacridin-9-ylidene)-(phenylthio)methyl] dihydrogen phosphate; yttrium Formula: C21H18NO4PSY2 MolecularWeight: 589.222381

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C(OP(=O)(O)O)SC3=CC=CC=C3)C4=CC=CC=C41.[Y].[Y]

Isomeric SMILES

CN1C2=CC=CC=C2C(=C(OP(=O)(O)O)SC3=CC=CC=C3)C4=CC=CC=C41.[Y].[Y]

InChI

InChI=1S/C21H18NO4PS.2Y/c1-22-18-13-7-5-11-16(18)20(17-12-6-8-14-19(17)22)21(26-27(23,24)25)28-15-9-3-2-4-10-15;;/h2-14H,1H3,(H2,23,24,25);;