[9-[(2,5-dimethylphenyl)methyl]-8-(4-fluorophenyl)-1,2,3,4-tetrahydrocarbazol-3-yl] benzoate

Systemtic Name: [9-[(2,5-dimethylphenyl)methyl]-8-(4-fluorophenyl)-1,2,3,4-tetrahydrocarbazol-3-yl] benzoate Openeye Name: [9-[(2,5-dimethylphenyl)methyl]-8-(4-fluorophenyl)-1,2,3,4-tetrahydrocarbazol-3-yl] benzoate CAS Name: benzoic acid [9-[(2,5-dimethylphenyl)methyl]-8-(4-fluorophenyl)-1,2,3,4-tetrahydrocarbazol-3-yl] ester IUPAC Name: [9-[(2,5-dimethylphenyl)methyl]-8-(4-fluorophenyl)-1,2,3,4-tetrahydrocarbazol-3-yl] benzoate Traditional Name: benzoic acid [9-(2,5-dimethylbenzyl)-8-(4-fluorophenyl)-1,2,3,4-tetrahydrocarbazol-3-yl] ester Formula: C34H30FNO2 MolecularWeight: 503.605903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CN2C3=C(CC(CC3)OC(=O)C4=CC=CC=C4)C5=C2C(=CC=C5)C6=CC=C(C=C6)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)CN2C3=C(CC(CC3)OC(=O)C4=CC=CC=C4)C5=C2C(=CC=C5)C6=CC=C(C=C6)F

InChI

InChI=1S/C34H30FNO2/c1-22-11-12-23(2)26(19-22)21-36-32-18-17-28(38-34(37)25-7-4-3-5-8-25)20-31(32)30-10-6-9-29(33(30)36)24-13-15-27(35)16-14-24/h3-16,19,28H,17-18,20-21H2,1-2H3