ethyl (2E,4E)-5-[6-methyl-2-(3-oxidanylidenebutyl)quinolin-3-yl]penta-2,4-dienoate

Systemtic Name: ethyl (2E,4E)-5-[6-methyl-2-(3-oxidanylidenebutyl)quinolin-3-yl]penta-2,4-dienoate Openeye Name: ethyl (2E,4E)-5-[6-methyl-2-(3-oxobutyl)-3-quinolyl]penta-2,4-dienoate CAS Name: (2E,4E)-5-[6-methyl-2-(3-oxobutyl)-3-quinolinyl]penta-2,4-dienoic acid ethyl ester IUPAC Name: ethyl (2E,4E)-5-[6-methyl-2-(3-oxobutyl)quinolin-3-yl]penta-2,4-dienoate Traditional Name: (2E,4E)-5-[2-(3-ketobutyl)-6-methyl-3-quinolyl]penta-2,4-dienoic acid ethyl ester Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC=CC1=C(N=C2C=CC(=CC2=C1)C)CCC(=O)C

Isomeric SMILES

CCOC(=O)/C=C/C=C/C1=C(N=C2C=CC(=CC2=C1)C)CCC(=O)C

InChI

InChI=1S/C21H23NO3/c1-4-25-21(24)8-6-5-7-17-14-18-13-15(2)9-11-20(18)22-19(17)12-10-16(3)23/h5-9,11,13-14H,4,10,12H2,1-3H3/b7-5+,8-6+