[4-[6-bromanyl-2-(3-methylphenyl)quinolin-4-yl]carbonylpiperazin-1-yl]-(oxolan-2-yl)methanone

Systemtic Name: [4-[6-bromanyl-2-(3-methylphenyl)quinolin-4-yl]carbonylpiperazin-1-yl]-(oxolan-2-yl)methanone Openeye Name: [4-[6-bromo-2-(m-tolyl)quinoline-4-carbonyl]piperazin-1-yl]-tetrahydrofuran-2-yl-methanone CAS Name: [4-[[6-bromo-2-(3-methylphenyl)-4-quinolinyl]-oxomethyl]-1-piperazinyl]-(2-oxolanyl)methanone IUPAC Name: [4-[6-bromo-2-(3-methylphenyl)quinoline-4-carbonyl]piperazin-1-yl]-(oxolan-2-yl)methanone Traditional Name: [4-[6-bromo-2-(m-tolyl)quinoline-4-carbonyl]piperazino]-(tetrahydrofuryl)methanone Formula: C26H26BrN3O3 MolecularWeight: 508.40694

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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)N4CCN(CC4)C(=O)C5CCCO5

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)N4CCN(CC4)C(=O)C5CCCO5

InChI

InChI=1S/C26H26BrN3O3/c1-17-4-2-5-18(14-17)23-16-21(20-15-19(27)7-8-22(20)28-23)25(31)29-9-11-30(12-10-29)26(32)24-6-3-13-33-24/h2,4-5,7-8,14-16,24H,3,6,9-13H2,1H3