N,N'-bis[4-(3-methylbutanoylamino)phenyl]nonanediamide

Systemtic Name: N,N'-bis[4-(3-methylbutanoylamino)phenyl]nonanediamide Openeye Name: N,N'-bis[4-(3-methylbutanoylamino)phenyl]nonanediamide CAS Name: N,N'-bis[4-[(3-methyl-1-oxobutyl)amino]phenyl]nonanediamide IUPAC Name: N,N'-bis[4-(3-methylbutanoylamino)phenyl]nonanediamide Traditional Name: N,N'-bis[4-(isovalerylamino)phenyl]azelaamide Formula: C31H44N4O4 MolecularWeight: 536.70546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)CCCCCCCC(=O)NC2=CC=C(C=C2)NC(=O)CC(C)C

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)CCCCCCCC(=O)NC2=CC=C(C=C2)NC(=O)CC(C)C

InChI

InChI=1S/C31H44N4O4/c1-22(2)20-30(38)34-26-16-12-24(13-17-26)32-28(36)10-8-6-5-7-9-11-29(37)33-25-14-18-27(19-15-25)35-31(39)21-23(3)4/h12-19,22-23H,5-11,20-21H2,1-4H3,(H,32,36)(H,33,37)(H,34,38)(H,35,39)