1,2,3,4-tetrahydroacridine-9-carboxylic acid dihydrate

Systemtic Name: 1,2,3,4-tetrahydroacridine-9-carboxylic acid dihydrate Openeye Name: 1,2,3,4-tetrahydroacridine-9-carboxylic acid dihydrate CAS Name: 1,2,3,4-tetrahydroacridine-9-carboxylic acid dihydrate IUPAC Name: 1,2,3,4-tetrahydroacridine-9-carboxylic acid dihydrate Traditional Name: 1,2,3,4-tetrahydroacridine-9-carboxylic acid dihydrate Formula: C14H17NO4 MolecularWeight: 263.28908

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)O.O.O

Isomeric SMILES

C1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)O.O.O

InChI

InChI=1S/C14H13NO2.2H2O/c16-14(17)13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13;;/h1,3,5,7H,2,4,6,8H2,(H,16,17);2*1H2