1-[(4-methoxy-3-phenylmethoxy-phenyl)methyl]-4-propan-2-yl-piperazin-4-ium

Systemtic Name: 1-[(4-methoxy-3-phenylmethoxy-phenyl)methyl]-4-propan-2-yl-piperazin-4-ium Openeye Name: 1-[(3-benzyloxy-4-methoxy-phenyl)methyl]-4-isopropyl-piperazin-4-ium CAS Name: 1-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-4-propan-2-ylpiperazin-4-ium IUPAC Name: 1-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-4-propan-2-ylpiperazin-4-ium Traditional Name: 1-(3-benzoxy-4-methoxy-benzyl)-4-isopropyl-piperazin-4-ium Formula: C22H31N2O2+ MolecularWeight: 355.49374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCN(CC1)CC2=CC(=C(C=C2)OC)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)[NH+]1CCN(CC1)CC2=CC(=C(C=C2)OC)OCC3=CC=CC=C3

InChI

InChI=1S/C22H30N2O2/c1-18(2)24-13-11-23(12-14-24)16-20-9-10-21(25-3)22(15-20)26-17-19-7-5-4-6-8-19/h4-10,15,18H,11-14,16-17H2,1-3H3/p+1