9-(3,5-dimethyl-4-propoxy-phenyl)-10-fluoranyl-2-oxidanyl-6,11-dihydro-5H-benzo[a]carbazole-3-carboxylic acid

Systemtic Name: 9-(3,5-dimethyl-4-propoxy-phenyl)-10-fluoranyl-2-oxidanyl-6,11-dihydro-5H-benzo[a]carbazole-3-carboxylic acid Openeye Name: 9-(3,5-dimethyl-4-propoxy-phenyl)-10-fluoro-2-hydroxy-6,11-dihydro-5H-benzo[a]carbazole-3-carboxylic acid CAS Name: 9-(3,5-dimethyl-4-propoxyphenyl)-10-fluoro-2-hydroxy-6,11-dihydro-5H-benzo[a]carbazole-3-carboxylic acid IUPAC Name: 9-(3,5-dimethyl-4-propoxyphenyl)-10-fluoro-2-hydroxy-6,11-dihydro-5H-benzo[a]carbazole-3-carboxylic acid Traditional Name: 9-(3,5-dimethyl-4-propoxy-phenyl)-10-fluoro-2-hydroxy-6,11-dihydro-5H-benzo[a]carbazole-3-carboxylic acid Formula: C28H26FNO4 MolecularWeight: 459.508743

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1C)C2=C(C3=C(C=C2)C4=C(N3)C5=CC(=C(C=C5CC4)C(=O)O)O)F)C

Isomeric SMILES

CCCOC1=C(C=C(C=C1C)C2=C(C3=C(C=C2)C4=C(N3)C5=CC(=C(C=C5CC4)C(=O)O)O)F)C

InChI

InChI=1S/C28H26FNO4/c1-4-9-34-27-14(2)10-17(11-15(27)3)18-7-8-20-19-6-5-16-12-22(28(32)33)23(31)13-21(16)25(19)30-26(20)24(18)29/h7-8,10-13,30-31H,4-6,9H2,1-3H3,(H,32,33)