1-(3-methoxyphenyl)-4-[(2S)-2-phenylpropyl]piperazin-4-ium

Systemtic Name: 1-(3-methoxyphenyl)-4-[(2S)-2-phenylpropyl]piperazin-4-ium Openeye Name: 1-(3-methoxyphenyl)-4-[(2S)-2-phenylpropyl]piperazin-4-ium CAS Name: 1-(3-methoxyphenyl)-4-[(2S)-2-phenylpropyl]piperazin-4-ium IUPAC Name: 1-(3-methoxyphenyl)-4-[(2S)-2-phenylpropyl]piperazin-4-ium Traditional Name: 1-(3-methoxyphenyl)-4-[(2S)-2-phenylpropyl]piperazin-4-ium Formula: C20H27N2O+ MolecularWeight: 311.44118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C[NH+]1CCN(CC1)C2=CC(=CC=C2)OC)C3=CC=CC=C3

InChI

InChI=1S/C20H26N2O/c1-17(18-7-4-3-5-8-18)16-21-11-13-22(14-12-21)19-9-6-10-20(15-19)23-2/h3-10,15,17H,11-14,16H2,1-2H3/p+1/t17-/m1/s1