2-[[(3,4-dimethoxyphenyl)methyl-propyl-amino]methyl]-6-fluoranyl-1H-quinolin-4-one

Systemtic Name: 2-[[(3,4-dimethoxyphenyl)methyl-propyl-amino]methyl]-6-fluoranyl-1H-quinolin-4-one Openeye Name: 2-[[(3,4-dimethoxyphenyl)methyl-propyl-amino]methyl]-6-fluoro-1H-quinolin-4-one CAS Name: 2-[[(3,4-dimethoxyphenyl)methyl-propylamino]methyl]-6-fluoro-1H-quinolin-4-one IUPAC Name: 2-[[(3,4-dimethoxyphenyl)methyl-propylamino]methyl]-6-fluoro-1H-quinolin-4-one Traditional Name: 6-fluoro-2-[[propyl(veratryl)amino]methyl]-4-quinolone Formula: C22H25FN2O3 MolecularWeight: 384.443903

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC(=C(C=C1)OC)OC)CC2=CC(=O)C3=C(N2)C=CC(=C3)F

Isomeric SMILES

CCCN(CC1=CC(=C(C=C1)OC)OC)CC2=CC(=O)C3=C(N2)C=CC(=C3)F

InChI

InChI=1S/C22H25FN2O3/c1-4-9-25(13-15-5-8-21(27-2)22(10-15)28-3)14-17-12-20(26)18-11-16(23)6-7-19(18)24-17/h5-8,10-12H,4,9,13-14H2,1-3H3,(H,24,26)