[6-bromanyl-2-(3,4-dimethylphenyl)quinolin-4-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [6-bromanyl-2-(3,4-dimethylphenyl)quinolin-4-yl]-pyrrolidin-1-yl-methanone Openeye Name: [6-bromo-2-(3,4-dimethylphenyl)-4-quinolyl]-pyrrolidin-1-yl-methanone CAS Name: [6-bromo-2-(3,4-dimethylphenyl)-4-quinolinyl]-(1-pyrrolidinyl)methanone IUPAC Name: [6-bromo-2-(3,4-dimethylphenyl)quinolin-4-yl]-pyrrolidin-1-ylmethanone Traditional Name: [6-bromo-2-(3,4-dimethylphenyl)-4-quinolyl]-pyrrolidino-methanone Formula: C22H21BrN2O MolecularWeight: 409.31894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)N4CCCC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)N4CCCC4)C

InChI

InChI=1S/C22H21BrN2O/c1-14-5-6-16(11-15(14)2)21-13-19(22(26)25-9-3-4-10-25)18-12-17(23)7-8-20(18)24-21/h5-8,11-13H,3-4,9-10H2,1-2H3