N-(2-bromanyl-4-methyl-phenyl)-2-[4-[(2R)-oxolan-2-yl]carbonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-2-[4-[(2R)-oxolan-2-yl]carbonylpiperazin-1-yl]ethanamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-2-[4-[(2R)-tetrahydrofuran-2-carbonyl]piperazin-1-yl]acetamide CAS Name: N-(2-bromo-4-methylphenyl)-2-[4-[oxo-[(2R)-2-oxolanyl]methyl]-1-piperazinyl]acetamide IUPAC Name: N-(2-bromo-4-methylphenyl)-2-[4-[(2R)-oxolane-2-carbonyl]piperazin-1-yl]acetamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-2-[4-[(2R)-tetrahydrofuran-2-carbonyl]piperazino]acetamide Formula: C18H24BrN3O3 MolecularWeight: 410.30546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CN2CCN(CC2)C(=O)C3CCCO3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CN2CCN(CC2)C(=O)[C@H]3CCCO3)Br

InChI

InChI=1S/C18H24BrN3O3/c1-13-4-5-15(14(19)11-13)20-17(23)12-21-6-8-22(9-7-21)18(24)16-3-2-10-25-16/h4-5,11,16H,2-3,6-10,12H2,1H3,(H,20,23)/t16-/m1/s1