2-azanyl-1-(4-chlorophenyl)-1H-isoquinolin-2-ium-2-carbaldehyde; perchloric acid

Systemtic Name: 2-azanyl-1-(4-chlorophenyl)-1H-isoquinolin-2-ium-2-carbaldehyde; perchloric acid Openeye Name: 2-amino-1-(4-chlorophenyl)-1H-isoquinolin-2-ium-2-carbaldehyde; perchloric acid CAS Name: 2-amino-1-(4-chlorophenyl)-1H-isoquinolin-2-ium-2-carboxaldehyde; perchloric acid IUPAC Name: 2-amino-1-(4-chlorophenyl)-1H-isoquinolin-2-ium-2-carbaldehyde; perchloric acid Traditional Name: 2-amino-1-(4-chlorophenyl)-1H-isoquinolin-2-ium-2-carbaldehyde; perchloric acid Formula: C16H15Cl2N2O5+ MolecularWeight: 386.2067

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C([N+](C=CC2=C1)(C=O)N)C3=CC=C(C=C3)Cl.OCl(=O)(=O)=O

Isomeric SMILES

C1=CC=C2C([N+](C=CC2=C1)(C=O)N)C3=CC=C(C=C3)Cl.OCl(=O)(=O)=O

InChI

InChI=1S/C16H14ClN2O.ClHO4/c17-14-7-5-13(6-8-14)16-15-4-2-1-3-12(15)9-10-19(16,18)11-20;2-1(3,4)5/h1-11,16H,18H2;(H,2,3,4,5)/q+1;