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[3,5,7-tris(2-carboxyethyl)-1-adamantyl]azanium chloride

[3,5,7-tris(2-carboxyethyl)-1-adamantyl]azanium chloride

Systemtic Name:[3,5,7-tris(2-carboxyethyl)-1-adamantyl]azanium chloride
Openeye Name:[3,5,7-tris(2-carboxyethyl)-1-adamantyl]ammonium chloride
CAS Name:[3,5,7-tris(2-carboxyethyl)-1-adamantyl]ammonium chloride
IUPAC Name:[3,5,7-tris(2-carboxyethyl)-1-adamantyl]azanium chloride
Traditional Name:[3,5,7-tris(2-carboxyethyl)-1-adamantyl]ammonium chloride
Formula: C19H30ClNO6
MolecularWeight: 403.8976
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Descriptors Computed from Structure

Canonical SMILES:

C1C2(CC3(CC1(CC(C2)(C3)[NH3+])CCC(=O)O)CCC(=O)O)CCC(=O)O.[Cl-]


Isomeric SMILES

C1C2(CC3(CC1(CC(C2)(C3)[NH3+])CCC(=O)O)CCC(=O)O)CCC(=O)O.[Cl-]


InChI

InChI=1S/C19H29NO6.ClH/c20-19-10-16(4-1-13(21)22)7-17(11-19,5-2-14(23)24)9-18(8-16,12-19)6-3-15(25)26;/h1-12,20H2,(H,21,22)(H,23,24)(H,25,26);1H


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