1-(2-methoxyphenyl)-4-[(2S)-4-(4-methoxyphenyl)butan-2-yl]piperazin-4-ium

Systemtic Name: 1-(2-methoxyphenyl)-4-[(2S)-4-(4-methoxyphenyl)butan-2-yl]piperazin-4-ium Openeye Name: 1-(2-methoxyphenyl)-4-[(1S)-3-(4-methoxyphenyl)-1-methyl-propyl]piperazin-4-ium CAS Name: 1-(2-methoxyphenyl)-4-[(2S)-4-(4-methoxyphenyl)butan-2-yl]piperazin-4-ium IUPAC Name: 1-(2-methoxyphenyl)-4-[(2S)-4-(4-methoxyphenyl)butan-2-yl]piperazin-4-ium Traditional Name: 1-(2-methoxyphenyl)-4-[(1S)-3-(4-methoxyphenyl)-1-methyl-propyl]piperazin-4-ium Formula: C22H31N2O2+ MolecularWeight: 355.49374

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(C=C1)OC)[NH+]2CCN(CC2)C3=CC=CC=C3OC

Isomeric SMILES

C[C@@H](CCC1=CC=C(C=C1)OC)[NH+]2CCN(CC2)C3=CC=CC=C3OC

InChI

InChI=1S/C22H30N2O2/c1-18(8-9-19-10-12-20(25-2)13-11-19)23-14-16-24(17-15-23)21-6-4-5-7-22(21)26-3/h4-7,10-13,18H,8-9,14-17H2,1-3H3/p+1/t18-/m0/s1