(3-bromanyl-5-methyl-2-oxidanyl-phenyl)methylidene-[2-[(2-chloranyl-4-nitro-phenyl)amino]ethyl]azanium

Systemtic Name: (3-bromanyl-5-methyl-2-oxidanyl-phenyl)methylidene-[2-[(2-chloranyl-4-nitro-phenyl)amino]ethyl]azanium Openeye Name: (3-bromo-2-hydroxy-5-methyl-phenyl)methylene-[2-(2-chloro-4-nitro-anilino)ethyl]ammonium CAS Name: (3-bromo-2-hydroxy-5-methylphenyl)methylidene-[2-(2-chloro-4-nitroanilino)ethyl]ammonium IUPAC Name: (3-bromo-2-hydroxy-5-methylphenyl)methylidene-[2-(2-chloro-4-nitroanilino)ethyl]azanium Traditional Name: (3-bromo-2-hydroxy-5-methyl-benzylidene)-[2-(2-chloro-4-nitro-anilino)ethyl]ammonium Formula: C16H16BrClN3O3+ MolecularWeight: 413.67354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C=[NH+]CCNC2=C(C=C(C=C2)[N+](=O)[O-])Cl)O)Br

Isomeric SMILES

CC1=CC(=C(C(=C1)C=[NH+]CCNC2=C(C=C(C=C2)[N+](=O)[O-])Cl)O)Br

InChI

InChI=1S/C16H15BrClN3O3/c1-10-6-11(16(22)13(17)7-10)9-19-4-5-20-15-3-2-12(21(23)24)8-14(15)18/h2-3,6-9,20,22H,4-5H2,1H3/p+1