[3-ethyl-2-[(E)-non-2-enyl]quinolin-4-yl] butanoate

Systemtic Name: [3-ethyl-2-[(E)-non-2-enyl]quinolin-4-yl] butanoate Openeye Name: [3-ethyl-2-[(E)-non-2-enyl]-4-quinolyl] butanoate CAS Name: butanoic acid [3-ethyl-2-[(E)-non-2-enyl]-4-quinolinyl] ester IUPAC Name: [3-ethyl-2-[(E)-non-2-enyl]quinolin-4-yl] butanoate Traditional Name: butyric acid [3-ethyl-2-[(E)-non-2-enyl]-4-quinolyl] ester Formula: C24H33NO2 MolecularWeight: 367.52432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CCC1=NC2=CC=CC=C2C(=C1CC)OC(=O)CCC

Isomeric SMILES

CCCCCC/C=C/CC1=NC2=CC=CC=C2C(=C1CC)OC(=O)CCC

InChI

InChI=1S/C24H33NO2/c1-4-7-8-9-10-11-12-17-21-19(6-3)24(27-23(26)15-5-2)20-16-13-14-18-22(20)25-21/h11-14,16,18H,4-10,15,17H2,1-3H3/b12-11+