1-[(4-methoxyphenyl)methyl]-4-pentan-3-yl-piperazin-4-ium

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-4-pentan-3-yl-piperazin-4-ium Openeye Name: 1-(1-ethylpropyl)-4-[(4-methoxyphenyl)methyl]piperazin-1-ium CAS Name: 1-[(4-methoxyphenyl)methyl]-4-pentan-3-ylpiperazin-4-ium IUPAC Name: 1-[(4-methoxyphenyl)methyl]-4-pentan-3-ylpiperazin-4-ium Traditional Name: 1-(1-ethylpropyl)-4-p-anisyl-piperazin-1-ium Formula: C17H29N2O+ MolecularWeight: 277.42496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H28N2O/c1-4-16(5-2)19-12-10-18(11-13-19)14-15-6-8-17(20-3)9-7-15/h6-9,16H,4-5,10-14H2,1-3H3/p+1