cyanomethyl 7-bromanyl-1,2,3,4-tetrahydroacridine-9-carboxylate

Systemtic Name: cyanomethyl 7-bromanyl-1,2,3,4-tetrahydroacridine-9-carboxylate Openeye Name: cyanomethyl 7-bromo-1,2,3,4-tetrahydroacridine-9-carboxylate CAS Name: 7-bromo-1,2,3,4-tetrahydroacridine-9-carboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl 7-bromo-1,2,3,4-tetrahydroacridine-9-carboxylate Traditional Name: 7-bromo-1,2,3,4-tetrahydroacridine-9-carboxylic acid cyanomethyl ester Formula: C16H13BrN2O2 MolecularWeight: 345.19062

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C3C=C(C=CC3=N2)Br)C(=O)OCC#N

Isomeric SMILES

C1CCC2=C(C1)C(=C3C=C(C=CC3=N2)Br)C(=O)OCC#N

InChI

InChI=1S/C16H13BrN2O2/c17-10-5-6-14-12(9-10)15(16(20)21-8-7-18)11-3-1-2-4-13(11)19-14/h5-6,9H,1-4,8H2