ethyl 2-[[(2E,4E)-hexa-2,4-dienoyl]oxymethyl]-4-methyl-quinoline-3-carboxylate

Systemtic Name: ethyl 2-[[(2E,4E)-hexa-2,4-dienoyl]oxymethyl]-4-methyl-quinoline-3-carboxylate Openeye Name: ethyl 2-[[(2E,4E)-hexa-2,4-dienoyl]oxymethyl]-4-methyl-quinoline-3-carboxylate CAS Name: 4-methyl-2-[[(2E,4E)-1-oxohexa-2,4-dienoxy]methyl]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(2E,4E)-hexa-2,4-dienoyl]oxymethyl]-4-methylquinoline-3-carboxylate Traditional Name: 2-[[(2E,4E)-hexa-2,4-dienoyl]oxymethyl]-4-methyl-quinoline-3-carboxylic acid ethyl ester Formula: C20H21NO4 MolecularWeight: 339.38504

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)C=CC=CC)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)/C=C/C=C/C)C

InChI

InChI=1S/C20H21NO4/c1-4-6-7-12-18(22)25-13-17-19(20(23)24-5-2)14(3)15-10-8-9-11-16(15)21-17/h4,6-12H,5,13H2,1-3H3/b6-4+,12-7+