N-[2-(3,4-dimethoxyphenyl)ethyl]-6-fluoranyl-2-methyl-quinoline-3-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-fluoranyl-2-methyl-quinoline-3-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-fluoro-2-methyl-quinoline-3-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-fluoro-2-methyl-3-quinolinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-fluoro-2-methylquinoline-3-carboxamide Traditional Name: 6-fluoro-N-homoveratryl-2-methyl-quinoline-3-carboxamide Formula: C21H21FN2O3 MolecularWeight: 368.401443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=C(C=CC2=N1)F)C(=O)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=C(C=C2C=C(C=CC2=N1)F)C(=O)NCCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H21FN2O3/c1-13-17(12-15-11-16(22)5-6-18(15)24-13)21(25)23-9-8-14-4-7-19(26-2)20(10-14)27-3/h4-7,10-12H,8-9H2,1-3H3,(H,23,25)