6-methoxy-1-phenyl-2-(phenylmethyl)-3,4-dihydroisoquinolin-2-ium bromide

Systemtic Name: 6-methoxy-1-phenyl-2-(phenylmethyl)-3,4-dihydroisoquinolin-2-ium bromide Openeye Name: 2-benzyl-6-methoxy-1-phenyl-3,4-dihydroisoquinolin-2-ium bromide CAS Name: 6-methoxy-1-phenyl-2-(phenylmethyl)-3,4-dihydroisoquinolin-2-ium bromide IUPAC Name: 2-benzyl-6-methoxy-1-phenyl-3,4-dihydroisoquinolin-2-ium bromide Traditional Name: 2-benzyl-6-methoxy-1-phenyl-3,4-dihydroisoquinolin-2-ium bromide Formula: C23H22BrNO MolecularWeight: 408.33088

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=[N+](CC2)CC3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

COC1=CC2=C(C=C1)C(=[N+](CC2)CC3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C23H22NO.BrH/c1-25-21-12-13-22-20(16-21)14-15-24(17-18-8-4-2-5-9-18)23(22)19-10-6-3-7-11-19;/h2-13,16H,14-15,17H2,1H3;1H/q+1;/p-1