N-[(3-bromophenyl)methyl]-N'-[(2S)-2-ethylhexyl]butanediamide

Systemtic Name: N-[(3-bromophenyl)methyl]-N'-[(2S)-2-ethylhexyl]butanediamide Openeye Name: N-[(3-bromophenyl)methyl]-N'-[(2S)-2-ethylhexyl]butanediamide CAS Name: N-[(3-bromophenyl)methyl]-N'-[(2S)-2-ethylhexyl]butanediamide IUPAC Name: N-[(3-bromophenyl)methyl]-N'-[(2S)-2-ethylhexyl]butanediamide Traditional Name: N-(3-bromobenzyl)-N'-[(2S)-2-ethylhexyl]succinamide Formula: C19H29BrN2O2 MolecularWeight: 397.34976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)CCC(=O)NCC1=CC(=CC=C1)Br

Isomeric SMILES

CCCC[C@H](CC)CNC(=O)CCC(=O)NCC1=CC(=CC=C1)Br

InChI

InChI=1S/C19H29BrN2O2/c1-3-5-7-15(4-2)13-21-18(23)10-11-19(24)22-14-16-8-6-9-17(20)12-16/h6,8-9,12,15H,3-5,7,10-11,13-14H2,1-2H3,(H,21,23)(H,22,24)/t15-/m0/s1