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

Systemtic Name: [(2S,3S)-1-cyclohexyl-3-phenyl-aziridin-1-ium-2-yl]-phenyl-methanone Openeye Name: [(2S,3S)-1-cyclohexyl-3-phenyl-aziridin-1-ium-2-yl]-phenyl-methanone CAS Name: [(2S,3S)-1-cyclohexyl-3-phenyl-2-aziridin-1-iumyl]-phenylmethanone IUPAC Name: [(2S,3S)-1-cyclohexyl-3-phenylaziridin-1-ium-2-yl]-phenylmethanone Traditional Name: [(2S,3S)-1-cyclohexyl-3-phenyl-ethylenimin-1-ium-2-yl]-phenyl-methanone Formula: C21H24NO+ MolecularWeight: 306.42136

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2C(C2C(=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)[NH+]2[C@H]([C@H]2C(=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H23NO/c23-21(17-12-6-2-7-13-17)20-19(16-10-4-1-5-11-16)22(20)18-14-8-3-9-15-18/h1-2,4-7,10-13,18-20H,3,8-9,14-15H2/p+1/t19-,20-,22?/m0/s1