2-[(2R)-1-methoxy-3-phenyl-propan-2-yl]-3,4-dihydroisoquinolin-2-ium; tetraphenylboranuide

Systemtic Name: 2-[(2R)-1-methoxy-3-phenyl-propan-2-yl]-3,4-dihydroisoquinolin-2-ium; tetraphenylboranuide Openeye Name: 2-[(1R)-1-benzyl-2-methoxy-ethyl]-3,4-dihydroisoquinolin-2-ium; tetraphenylboranuide CAS Name: 2-[(2R)-1-methoxy-3-phenylpropan-2-yl]-3,4-dihydroisoquinolin-2-ium; tetraphenylboranuide IUPAC Name: 2-[(2R)-1-methoxy-3-phenylpropan-2-yl]-3,4-dihydroisoquinolin-2-ium; tetraphenylboranuide Traditional Name: 2-[(1R)-1-benzyl-2-methoxy-ethyl]-3,4-dihydroisoquinolin-2-ium; tetraphenylboranuide Formula: C43H42BNO MolecularWeight: 599.61068

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Descriptors Computed from Structure

Canonical SMILES:

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.COCC(CC1=CC=CC=C1)[N+]2=CC3=CC=CC=C3CC2

Isomeric SMILES

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.COC[C@@H](CC1=CC=CC=C1)[N+]2=CC3=CC=CC=C3CC2

InChI

InChI=1S/C24H20B.C19H22NO/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-21-15-19(13-16-7-3-2-4-8-16)20-12-11-17-9-5-6-10-18(17)14-20/h1-20H;2-10,14,19H,11-13,15H2,1H3/q-1;+1/t;19-/m.1/s1