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2-[(1S,2S)-2-phenylmethoxycyclohexyl]-3,4-dihydroisoquinolin-2-ium

2-[(1S,2S)-2-phenylmethoxycyclohexyl]-3,4-dihydroisoquinolin-2-ium

Systemtic Name:2-[(1S,2S)-2-phenylmethoxycyclohexyl]-3,4-dihydroisoquinolin-2-ium
Openeye Name:2-[(1S,2S)-2-benzyloxycyclohexyl]-3,4-dihydroisoquinolin-2-ium
CAS Name:2-[(1S,2S)-2-phenylmethoxycyclohexyl]-3,4-dihydroisoquinolin-2-ium
IUPAC Name:2-[(1S,2S)-2-phenylmethoxycyclohexyl]-3,4-dihydroisoquinolin-2-ium
Traditional Name:2-[(1S,2S)-2-benzoxycyclohexyl]-3,4-dihydroisoquinolin-2-ium
Formula: C22H26NO+
MolecularWeight: 320.44794
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)[N+]2=CC3=CC=CC=C3CC2)OCC4=CC=CC=C4


Isomeric SMILES

C1CC[C@@H]([C@H](C1)[N+]2=CC3=CC=CC=C3CC2)OCC4=CC=CC=C4


InChI

InChI=1S/C22H26NO/c1-2-8-18(9-3-1)17-24-22-13-7-6-12-21(22)23-15-14-19-10-4-5-11-20(19)16-23/h1-5,8-11,16,21-22H,6-7,12-15,17H2/q+1/t21-,22-/m0/s1


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