1-(4-bromophenyl)-2-[7-(hydroxymethyl)-1-oxidanyl-2,3,5,8-tetrahydro-1H-pyrrolizin-4-ium-4-yl]ethanone

Systemtic Name: 1-(4-bromophenyl)-2-[7-(hydroxymethyl)-1-oxidanyl-2,3,5,8-tetrahydro-1H-pyrrolizin-4-ium-4-yl]ethanone Openeye Name: 1-(4-bromophenyl)-2-[1-hydroxy-7-(hydroxymethyl)-2,3,5,8-tetrahydro-1H-pyrrolizin-4-ium-4-yl]ethanone CAS Name: 1-(4-bromophenyl)-2-[1-hydroxy-7-(hydroxymethyl)-2,3,5,8-tetrahydro-1H-pyrrolizin-4-ium-4-yl]ethanone IUPAC Name: 1-(4-bromophenyl)-2-[1-hydroxy-7-(hydroxymethyl)-2,3,5,8-tetrahydro-1H-pyrrolizin-4-ium-4-yl]ethanone Traditional Name: 1-(4-bromophenyl)-2-(1-hydroxy-7-methylol-2,3,5,8-tetrahydro-1H-pyrrolizin-4-ium-4-yl)ethanone Formula: C16H19BrNO3+ MolecularWeight: 353.23096

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+]2(CC=C(C2C1O)CO)CC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1C[N+]2(CC=C(C2C1O)CO)CC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C16H19BrNO3/c17-13-3-1-11(2-4-13)15(21)9-18-7-5-12(10-19)16(18)14(20)6-8-18/h1-5,14,16,19-20H,6-10H2/q+1