[[[2,6-bis(chloranyl)-3,5-dimethyl-4-oxidanyl-phenyl]amino]-phenyl-methylidene]-(4-bromophenyl)sulfonyl-azanium

Systemtic Name: [[[2,6-bis(chloranyl)-3,5-dimethyl-4-oxidanyl-phenyl]amino]-phenyl-methylidene]-(4-bromophenyl)sulfonyl-azanium Openeye Name: (4-bromophenyl)sulfonyl-[(2,6-dichloro-4-hydroxy-3,5-dimethyl-anilino)-phenyl-methylene]ammonium CAS Name: (4-bromophenyl)sulfonyl-[(2,6-dichloro-4-hydroxy-3,5-dimethylanilino)-phenylmethylidene]ammonium IUPAC Name: (4-bromophenyl)sulfonyl-[(2,6-dichloro-4-hydroxy-3,5-dimethylanilino)-phenylmethylidene]azanium Traditional Name: brosyl-[(2,6-dichloro-4-hydroxy-3,5-dimethyl-anilino)-phenyl-methylene]ammonium Formula: C21H18BrCl2N2O3S+ MolecularWeight: 529.25422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1Cl)NC(=[NH+]S(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3)Cl)C)O

Isomeric SMILES

CC1=C(C(=C(C(=C1Cl)NC(=[NH+]S(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3)Cl)C)O

InChI

InChI=1S/C21H17BrCl2N2O3S/c1-12-17(23)19(18(24)13(2)20(12)27)25-21(14-6-4-3-5-7-14)26-30(28,29)16-10-8-15(22)9-11-16/h3-11,27H,1-2H3,(H,25,26)/p+1