[7-[2-(4-carbazol-9-ylphenyl)ethynyl]-5-chloranyl-quinolin-8-yl] ethanoate

Systemtic Name: [7-[2-(4-carbazol-9-ylphenyl)ethynyl]-5-chloranyl-quinolin-8-yl] ethanoate Openeye Name: [7-[2-(4-carbazol-9-ylphenyl)ethynyl]-5-chloro-8-quinolyl] acetate CAS Name: acetic acid [7-[2-[4-(9-carbazolyl)phenyl]ethynyl]-5-chloro-8-quinolinyl] ester IUPAC Name: [7-[2-(4-carbazol-9-ylphenyl)ethynyl]-5-chloroquinolin-8-yl] acetate Traditional Name: acetic acid [7-[2-(4-carbazol-9-ylphenyl)ethynyl]-5-chloro-8-quinolyl] ester Formula: C31H19ClN2O2 MolecularWeight: 486.94776

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C2C(=C(C=C1C#CC3=CC=C(C=C3)N4C5=CC=CC=C5C6=CC=CC=C64)Cl)C=CC=N2

Isomeric SMILES

CC(=O)OC1=C2C(=C(C=C1C#CC3=CC=C(C=C3)N4C5=CC=CC=C5C6=CC=CC=C64)Cl)C=CC=N2

InChI

InChI=1S/C31H19ClN2O2/c1-20(35)36-31-22(19-27(32)26-9-6-18-33-30(26)31)15-12-21-13-16-23(17-14-21)34-28-10-4-2-7-24(28)25-8-3-5-11-29(25)34/h2-11,13-14,16-19H,1H3