sodium 9-fluoranyl-3-(3-methylphenyl)-5,6-dihydrobenzo[c]acridine-7-carboxylate

Systemtic Name: sodium 9-fluoranyl-3-(3-methylphenyl)-5,6-dihydrobenzo[c]acridine-7-carboxylate Openeye Name: sodium 9-fluoro-3-(m-tolyl)-5,6-dihydrobenzo[c]acridine-7-carboxylate CAS Name: sodium 9-fluoro-3-(3-methylphenyl)-5,6-dihydrobenzo[c]acridine-7-carboxylate IUPAC Name: sodium 9-fluoro-3-(3-methylphenyl)-5,6-dihydrobenzo[c]acridine-7-carboxylate Traditional Name: sodium 9-fluoro-3-(m-tolyl)-5,6-dihydrobenz[c]acridine-7-carboxylate Formula: C25H17FNNaO2 MolecularWeight: 405.396153

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CC3=C(C=C2)C4=C(CC3)C(=C5C=C(C=CC5=N4)F)C(=O)[O-].[Na+]

Isomeric SMILES

CC1=CC=CC(=C1)C2=CC3=C(C=C2)C4=C(CC3)C(=C5C=C(C=CC5=N4)F)C(=O)[O-].[Na+]

InChI

InChI=1S/C25H18FNO2.Na/c1-14-3-2-4-15(11-14)16-5-8-19-17(12-16)6-9-20-23(25(28)29)21-13-18(26)7-10-22(21)27-24(19)20;/h2-5,7-8,10-13H,6,9H2,1H3,(H,28,29);/q;+1/p-1