[(2S,3S)-3-(4-bromophenyl)aziridin-1-ium-2-yl]-phenyl-methanone

Systemtic Name: [(2S,3S)-3-(4-bromophenyl)aziridin-1-ium-2-yl]-phenyl-methanone Openeye Name: [(2S,3S)-3-(4-bromophenyl)aziridin-1-ium-2-yl]-phenyl-methanone CAS Name: [(2S,3S)-3-(4-bromophenyl)-2-aziridin-1-iumyl]-phenylmethanone IUPAC Name: [(2S,3S)-3-(4-bromophenyl)aziridin-1-ium-2-yl]-phenylmethanone Traditional Name: [(2S,3S)-3-(4-bromophenyl)ethylenimin-1-ium-2-yl]-phenyl-methanone Formula: C15H13BrNO+ MolecularWeight: 303.17382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2C([NH2+]2)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)C(=O)[C@@H]2[C@@H]([NH2+]2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C15H12BrNO/c16-12-8-6-10(7-9-12)13-14(17-13)15(18)11-4-2-1-3-5-11/h1-9,13-14,17H/p+1/t13-,14-/m0/s1