N,N'-bis[5-(butanoylamino)-2-chloranyl-phenyl]nonanediamide

Systemtic Name: N,N'-bis[5-(butanoylamino)-2-chloranyl-phenyl]nonanediamide Openeye Name: N,N'-bis[5-(butanoylamino)-2-chloro-phenyl]nonanediamide CAS Name: N,N'-bis[2-chloro-5-(1-oxobutylamino)phenyl]nonanediamide IUPAC Name: N,N'-bis[5-(butanoylamino)-2-chlorophenyl]nonanediamide Traditional Name: N,N'-bis(5-butyramido-2-chloro-phenyl)azelaamide Formula: C29H38Cl2N4O4 MolecularWeight: 577.54242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H38Cl2N4O4/c1-3-10-26(36)32-20-14-16-22(30)24(18-20)34-28(38)12-8-6-5-7-9-13-29(39)35-25-19-21(15-17-23(25)31)33-27(37)11-4-2/h14-19H,3-13H2,1-2H3,(H,32,36)(H,33,37)(H,34,38)(H,35,39)