2-[[3-(2-octanoylhydrazinyl)-3-oxidanylidene-propanoyl]amino]benzoic acid

Systemtic Name: 2-[[3-(2-octanoylhydrazinyl)-3-oxidanylidene-propanoyl]amino]benzoic acid Openeye Name: 2-[[3-(2-octanoylhydrazino)-3-oxo-propanoyl]amino]benzoic acid CAS Name: 2-[[1,3-dioxo-3-(1-oxooctylhydrazo)propyl]amino]benzoic acid IUPAC Name: 2-[[3-(2-octanoylhydrazinyl)-3-oxopropanoyl]amino]benzoic acid Traditional Name: 2-[[3-(N'-caprylylhydrazino)-3-keto-propanoyl]amino]benzoic acid Formula: C18H25N3O5 MolecularWeight: 363.4082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NNC(=O)CC(=O)NC1=CC=CC=C1C(=O)O

Isomeric SMILES

CCCCCCCC(=O)NNC(=O)CC(=O)NC1=CC=CC=C1C(=O)O

InChI

InChI=1S/C18H25N3O5/c1-2-3-4-5-6-11-15(22)20-21-17(24)12-16(23)19-14-10-8-7-9-13(14)18(25)26/h7-10H,2-6,11-12H2,1H3,(H,19,23)(H,20,22)(H,21,24)(H,25,26)