1-(2-methoxyphenyl)-4-[(3R)-3-phenylbutyl]piperazin-4-ium

Systemtic Name: 1-(2-methoxyphenyl)-4-[(3R)-3-phenylbutyl]piperazin-4-ium Openeye Name: 1-(2-methoxyphenyl)-4-[(3R)-3-phenylbutyl]piperazin-4-ium CAS Name: 1-(2-methoxyphenyl)-4-[(3R)-3-phenylbutyl]piperazin-4-ium IUPAC Name: 1-(2-methoxyphenyl)-4-[(3R)-3-phenylbutyl]piperazin-4-ium Traditional Name: 1-(2-methoxyphenyl)-4-[(3R)-3-phenylbutyl]piperazin-4-ium Formula: C21H29N2O+ MolecularWeight: 325.46776

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC[NH+]1CCN(CC1)C2=CC=CC=C2OC)C3=CC=CC=C3

Isomeric SMILES

C[C@H](CC[NH+]1CCN(CC1)C2=CC=CC=C2OC)C3=CC=CC=C3

InChI

InChI=1S/C21H28N2O/c1-18(19-8-4-3-5-9-19)12-13-22-14-16-23(17-15-22)20-10-6-7-11-21(20)24-2/h3-11,18H,12-17H2,1-2H3/p+1/t18-/m1/s1