methyl 4-[2-(4-methoxyphenyl)ethynyl]-2-methyl-quinoline-3-carboxylate

Systemtic Name: methyl 4-[2-(4-methoxyphenyl)ethynyl]-2-methyl-quinoline-3-carboxylate Openeye Name: methyl 4-[2-(4-methoxyphenyl)ethynyl]-2-methyl-quinoline-3-carboxylate CAS Name: 4-[2-(4-methoxyphenyl)ethynyl]-2-methyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-(4-methoxyphenyl)ethynyl]-2-methylquinoline-3-carboxylate Traditional Name: 4-[2-(4-methoxyphenyl)ethynyl]-2-methyl-quinoline-3-carboxylic acid methyl ester Formula: C21H17NO3 MolecularWeight: 331.36458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1C(=O)OC)C#CC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1C(=O)OC)C#CC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H17NO3/c1-14-20(21(23)25-3)18(17-6-4-5-7-19(17)22-14)13-10-15-8-11-16(24-2)12-9-15/h4-9,11-12H,1-3H3