6-[(6-bromanyl-2-methoxy-quinolin-3-yl)-phenyl-methyl]-3,3-dimethyl-6-naphthalen-1-yl-1,3-oxazinan-3-ium iodide

Systemtic Name: 6-[(6-bromanyl-2-methoxy-quinolin-3-yl)-phenyl-methyl]-3,3-dimethyl-6-naphthalen-1-yl-1,3-oxazinan-3-ium iodide Openeye Name: 6-[(6-bromo-2-methoxy-3-quinolyl)-phenyl-methyl]-3,3-dimethyl-6-(1-naphthyl)-1,3-oxazinan-3-ium iodide CAS Name: 6-[(6-bromo-2-methoxy-3-quinolinyl)-phenylmethyl]-3,3-dimethyl-6-(1-naphthalenyl)-1,3-oxazinan-3-ium iodide IUPAC Name: 6-[(6-bromo-2-methoxyquinolin-3-yl)-phenylmethyl]-3,3-dimethyl-6-naphthalen-1-yl-1,3-oxazinan-3-ium iodide Traditional Name: 6-[(6-bromo-2-methoxy-3-quinolyl)-phenyl-methyl]-3,3-dimethyl-6-(1-naphthyl)-1,3-oxazinan-3-ium iodide Formula: C33H32BrIN2O2 MolecularWeight: 695.42785

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(OC1)(C2=CC=CC3=CC=CC=C32)C(C4=CC=CC=C4)C5=C(N=C6C=CC(=CC6=C5)Br)OC)C.[I-]

Isomeric SMILES

C[N+]1(CCC(OC1)(C2=CC=CC3=CC=CC=C32)C(C4=CC=CC=C4)C5=C(N=C6C=CC(=CC6=C5)Br)OC)C.[I-]

InChI

InChI=1S/C33H32BrN2O2.HI/c1-36(2)19-18-33(38-22-36,29-15-9-13-23-10-7-8-14-27(23)29)31(24-11-5-4-6-12-24)28-21-25-20-26(34)16-17-30(25)35-32(28)37-3;/h4-17,20-21,31H,18-19,22H2,1-3H3;1H/q+1;/p-1