2-bromanyl-N1,N3-bis[(2S)-1-chloranyl-3,3-dimethyl-butan-2-yl]benzene-1,3-dicarboxamide

Systemtic Name: 2-bromanyl-N1,N3-bis[(2S)-1-chloranyl-3,3-dimethyl-butan-2-yl]benzene-1,3-dicarboxamide Openeye Name: 2-bromo-N1,N3-bis[(1S)-1-(chloromethyl)-2,2-dimethyl-propyl]benzene-1,3-dicarboxamide CAS Name: 2-bromo-N1,N3-bis[(2S)-1-chloro-3,3-dimethylbutan-2-yl]benzene-1,3-dicarboxamide IUPAC Name: 2-bromo-1-N,3-N-bis[(2S)-1-chloro-3,3-dimethylbutan-2-yl]benzene-1,3-dicarboxamide Traditional Name: 2-bromo-N,N'-bis[(1S)-1-(chloromethyl)-2,2-dimethyl-propyl]isophthalamide Formula: C20H29BrCl2N2O2 MolecularWeight: 480.26646

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CCl)NC(=O)C1=C(C(=CC=C1)C(=O)NC(CCl)C(C)(C)C)Br

Isomeric SMILES

CC(C)(C)[C@@H](CCl)NC(=O)C1=C(C(=CC=C1)C(=O)N[C@H](CCl)C(C)(C)C)Br

InChI

InChI=1S/C20H29BrCl2N2O2/c1-19(2,3)14(10-22)24-17(26)12-8-7-9-13(16(12)21)18(27)25-15(11-23)20(4,5)6/h7-9,14-15H,10-11H2,1-6H3,(H,24,26)(H,25,27)/t14-,15-/m1/s1