3-azanyl-5-[3,6,9-tris(oxidanyl)decanoylamino]benzoic acid

Systemtic Name: 3-azanyl-5-[3,6,9-tris(oxidanyl)decanoylamino]benzoic acid Openeye Name: 3-amino-5-(3,6,9-trihydroxydecanoylamino)benzoic acid CAS Name: 3-amino-5-[(3,6,9-trihydroxy-1-oxodecyl)amino]benzoic acid IUPAC Name: 3-amino-5-(3,6,9-trihydroxydecanoylamino)benzoic acid Traditional Name: 3-amino-5-(3,6,9-trihydroxydecanoylamino)benzoic acid Formula: C17H26N2O6 MolecularWeight: 354.39814

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(CCC(CC(=O)NC1=CC(=CC(=C1)N)C(=O)O)O)O)O

Isomeric SMILES

CC(CCC(CCC(CC(=O)NC1=CC(=CC(=C1)N)C(=O)O)O)O)O

InChI

InChI=1S/C17H26N2O6/c1-10(20)2-3-14(21)4-5-15(22)9-16(23)19-13-7-11(17(24)25)6-12(18)8-13/h6-8,10,14-15,20-22H,2-5,9,18H2,1H3,(H,19,23)(H,24,25)