phenyl 4-ethynyl-4H-quinoline-1-carboxylate

Systemtic Name: phenyl 4-ethynyl-4H-quinoline-1-carboxylate Openeye Name: phenyl 4-ethynyl-4H-quinoline-1-carboxylate CAS Name: 4-ethynyl-4H-quinoline-1-carboxylic acid phenyl ester IUPAC Name: phenyl 4-ethynyl-4H-quinoline-1-carboxylate Traditional Name: 4-ethynyl-4H-quinoline-1-carboxylic acid phenyl ester Formula: C18H13NO2 MolecularWeight: 275.30132

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1C=CN(C2=CC=CC=C12)C(=O)OC3=CC=CC=C3

Isomeric SMILES

C#CC1C=CN(C2=CC=CC=C12)C(=O)OC3=CC=CC=C3

InChI

InChI=1S/C18H13NO2/c1-2-14-12-13-19(17-11-7-6-10-16(14)17)18(20)21-15-8-4-3-5-9-15/h1,3-14H