3-[3,4-bis(chloranyl)-2-methoxy-phenyl]sulfonyl-2-(phenylmethyl)-4,5-dihydro-1H-imidazol-3-ium

Systemtic Name: 3-[3,4-bis(chloranyl)-2-methoxy-phenyl]sulfonyl-2-(phenylmethyl)-4,5-dihydro-1H-imidazol-3-ium Openeye Name: 2-benzyl-3-(3,4-dichloro-2-methoxy-phenyl)sulfonyl-4,5-dihydro-1H-imidazol-3-ium CAS Name: 3-(3,4-dichloro-2-methoxyphenyl)sulfonyl-2-(phenylmethyl)-4,5-dihydro-1H-imidazol-3-ium IUPAC Name: 2-benzyl-3-(3,4-dichloro-2-methoxyphenyl)sulfonyl-4,5-dihydro-1H-imidazol-3-ium Traditional Name: 2-benzyl-1-(3,4-dichloro-2-methoxy-phenyl)sulfonyl-2-imidazolin-1-ium Formula: C17H17Cl2N2O3S+ MolecularWeight: 400.29948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1Cl)Cl)S(=O)(=O)[N+]2=C(NCC2)CC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1Cl)Cl)S(=O)(=O)[N+]2=C(NCC2)CC3=CC=CC=C3

InChI

InChI=1S/C17H16Cl2N2O3S/c1-24-17-14(8-7-13(18)16(17)19)25(22,23)21-10-9-20-15(21)11-12-5-3-2-4-6-12/h2-8H,9-11H2,1H3/p+1