1-[(2S)-5-(2,5-dimethoxyphenyl)pentan-2-yl]piperazin-4-ium

Systemtic Name: 1-[(2S)-5-(2,5-dimethoxyphenyl)pentan-2-yl]piperazin-4-ium Openeye Name: 1-[(1S)-4-(2,5-dimethoxyphenyl)-1-methyl-butyl]piperazin-4-ium CAS Name: 1-[(2S)-5-(2,5-dimethoxyphenyl)pentan-2-yl]piperazin-4-ium IUPAC Name: 1-[(2S)-5-(2,5-dimethoxyphenyl)pentan-2-yl]piperazin-4-ium Traditional Name: 1-[(1S)-4-(2,5-dimethoxyphenyl)-1-methyl-butyl]piperazin-4-ium Formula: C17H29N2O2+ MolecularWeight: 293.42436

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC1=C(C=CC(=C1)OC)OC)N2CC[NH2+]CC2

Isomeric SMILES

C[C@@H](CCCC1=C(C=CC(=C1)OC)OC)N2CC[NH2+]CC2

InChI

InChI=1S/C17H28N2O2/c1-14(19-11-9-18-10-12-19)5-4-6-15-13-16(20-2)7-8-17(15)21-3/h7-8,13-14,18H,4-6,9-12H2,1-3H3/p+1/t14-/m0/s1