methyl 2-[[cyclopropyl-[(4-fluorophenyl)methyl]amino]methyl]-4-methyl-quinoline-3-carboxylate

Systemtic Name: methyl 2-[[cyclopropyl-[(4-fluorophenyl)methyl]amino]methyl]-4-methyl-quinoline-3-carboxylate Openeye Name: methyl 2-[[cyclopropyl-[(4-fluorophenyl)methyl]amino]methyl]-4-methyl-quinoline-3-carboxylate CAS Name: 2-[[cyclopropyl-[(4-fluorophenyl)methyl]amino]methyl]-4-methyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[[cyclopropyl-[(4-fluorophenyl)methyl]amino]methyl]-4-methylquinoline-3-carboxylate Traditional Name: 2-[[cyclopropyl-(4-fluorobenzyl)amino]methyl]-4-methyl-quinoline-3-carboxylic acid methyl ester Formula: C23H23FN2O2 MolecularWeight: 378.439323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)CN(CC3=CC=C(C=C3)F)C4CC4)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)CN(CC3=CC=C(C=C3)F)C4CC4)C(=O)OC

InChI

InChI=1S/C23H23FN2O2/c1-15-19-5-3-4-6-20(19)25-21(22(15)23(27)28-2)14-26(18-11-12-18)13-16-7-9-17(24)10-8-16/h3-10,18H,11-14H2,1-2H3