[2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]quinolin-8-yl] propanoate

Systemtic Name: [2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]quinolin-8-yl] propanoate Openeye Name: [2-[(E)-2-(1,3-benzodioxol-5-yl)vinyl]-8-quinolyl] propanoate CAS Name: propanoic acid [2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-8-quinolinyl] ester IUPAC Name: [2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]quinolin-8-yl] propanoate Traditional Name: propionic acid [2-[(E)-2-(1,3-benzodioxol-5-yl)vinyl]-8-quinolyl] ester Formula: C21H17NO4 MolecularWeight: 347.36398

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=CC=CC2=C1N=C(C=C2)C=CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCC(=O)OC1=CC=CC2=C1N=C(C=C2)/C=C/C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H17NO4/c1-2-20(23)26-18-5-3-4-15-8-10-16(22-21(15)18)9-6-14-7-11-17-19(12-14)25-13-24-17/h3-12H,2,13H2,1H3/b9-6+