N,N'-bis[3-(butan-2-ylcarbamoyl)phenyl]nonanediamide

Systemtic Name: N,N'-bis[3-(butan-2-ylcarbamoyl)phenyl]nonanediamide Openeye Name: N,N'-bis[3-(sec-butylcarbamoyl)phenyl]nonanediamide CAS Name: N,N'-bis[3-[(butan-2-ylamino)-oxomethyl]phenyl]nonanediamide IUPAC Name: N,N'-bis[3-(butan-2-ylcarbamoyl)phenyl]nonanediamide Traditional Name: N,N'-bis[3-(sec-butylcarbamoyl)phenyl]azelaamide Formula: C31H44N4O4 MolecularWeight: 536.70546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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