4-[2-(6-bromanyl-5-methyl-2-oxidanylidene-indol-1-ium-3-yl)hydrazinyl]-N-(2,4-dimethylphenyl)-4-oxidanylidene-butanamide

Systemtic Name: 4-[2-(6-bromanyl-5-methyl-2-oxidanylidene-indol-1-ium-3-yl)hydrazinyl]-N-(2,4-dimethylphenyl)-4-oxidanylidene-butanamide Openeye Name: 4-[2-(6-bromo-5-methyl-2-oxo-indol-1-ium-3-yl)hydrazino]-N-(2,4-dimethylphenyl)-4-oxo-butanamide CAS Name: 4-[(6-bromo-5-methyl-2-oxo-3-indol-1-iumyl)hydrazo]-N-(2,4-dimethylphenyl)-4-oxobutanamide IUPAC Name: 4-[2-(6-bromo-5-methyl-2-oxoindol-1-ium-3-yl)hydrazinyl]-N-(2,4-dimethylphenyl)-4-oxobutanamide Traditional Name: 4-[N'-(6-bromo-2-keto-5-methyl-indol-1-ium-3-yl)hydrazino]-N-(2,4-dimethylphenyl)-4-keto-butyramide Formula: C21H22BrN4O3+ MolecularWeight: 458.32838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CCC(=O)NNC2=C3C=C(C(=CC3=[NH+]C2=O)Br)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CCC(=O)NNC2=C3C=C(C(=CC3=[NH+]C2=O)Br)C)C

InChI

InChI=1S/C21H21BrN4O3/c1-11-4-5-16(13(3)8-11)23-18(27)6-7-19(28)25-26-20-14-9-12(2)15(22)10-17(14)24-21(20)29/h4-5,8-10H,6-7H2,1-3H3,(H,23,27)(H,25,28)(H,24,26,29)/p+1