6-bromanyl-3-[(3,4-dimethylphenyl)amino]-5-methyl-indol-1-ium-2-one

Systemtic Name: 6-bromanyl-3-[(3,4-dimethylphenyl)amino]-5-methyl-indol-1-ium-2-one Openeye Name: 6-bromo-3-(3,4-dimethylanilino)-5-methyl-indol-1-ium-2-one CAS Name: 6-bromo-3-(3,4-dimethylanilino)-5-methyl-2-indol-1-iumone IUPAC Name: 6-bromo-3-(3,4-dimethylanilino)-5-methylindol-1-ium-2-one Traditional Name: 6-bromo-3-(3,4-dimethylanilino)-5-methyl-indol-1-ium-2-one Formula: C17H16BrN2O+ MolecularWeight: 344.22574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=C3C=C(C(=CC3=[NH+]C2=O)Br)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=C3C=C(C(=CC3=[NH+]C2=O)Br)C)C

InChI

InChI=1S/C17H15BrN2O/c1-9-4-5-12(6-10(9)2)19-16-13-7-11(3)14(18)8-15(13)20-17(16)21/h4-8H,1-3H3,(H,19,20,21)/p+1