6-bromanyl-2-(3-methylphenyl)-N-[[(2S)-oxolan-2-yl]methyl]quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-2-(3-methylphenyl)-N-[[(2S)-oxolan-2-yl]methyl]quinoline-4-carboxamide Openeye Name: 6-bromo-2-(m-tolyl)-N-[[(2S)-tetrahydrofuran-2-yl]methyl]quinoline-4-carboxamide CAS Name: 6-bromo-2-(3-methylphenyl)-N-[[(2S)-2-oxolanyl]methyl]-4-quinolinecarboxamide IUPAC Name: 6-bromo-2-(3-methylphenyl)-N-[[(2S)-oxolan-2-yl]methyl]quinoline-4-carboxamide Traditional Name: 6-bromo-2-(m-tolyl)-N-[[(2S)-tetrahydrofuran-2-yl]methyl]cinchoninamide Formula: C22H21BrN2O2 MolecularWeight: 425.31834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NCC4CCCO4

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC[C@@H]4CCCO4

InChI

InChI=1S/C22H21BrN2O2/c1-14-4-2-5-15(10-14)21-12-19(18-11-16(23)7-8-20(18)25-21)22(26)24-13-17-6-3-9-27-17/h2,4-5,7-8,10-12,17H,3,6,9,13H2,1H3,(H,24,26)/t17-/m0/s1