[(2S)-2-(5-bromanylfuran-2-yl)-2-(4-phenylpiperazin-1-yl)ethyl]azanium

Systemtic Name: [(2S)-2-(5-bromanylfuran-2-yl)-2-(4-phenylpiperazin-1-yl)ethyl]azanium Openeye Name: [(2S)-2-(5-bromo-2-furyl)-2-(4-phenylpiperazin-1-yl)ethyl]ammonium CAS Name: [(2S)-2-(5-bromo-2-furanyl)-2-(4-phenyl-1-piperazinyl)ethyl]ammonium IUPAC Name: [(2S)-2-(5-bromofuran-2-yl)-2-(4-phenylpiperazin-1-yl)ethyl]azanium Traditional Name: [(2S)-2-(5-bromo-2-furyl)-2-(4-phenylpiperazino)ethyl]ammonium Formula: C16H21BrN3O+ MolecularWeight: 351.26144

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(C[NH3+])C3=CC=C(O3)Br

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)[C@@H](C[NH3+])C3=CC=C(O3)Br

InChI

InChI=1S/C16H20BrN3O/c17-16-7-6-15(21-16)14(12-18)20-10-8-19(9-11-20)13-4-2-1-3-5-13/h1-7,14H,8-12,18H2/p+1/t14-/m0/s1