[5-bromanyl-2,3-bis(oxidanylidene)indol-1-yl]methyl-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: [5-bromanyl-2,3-bis(oxidanylidene)indol-1-yl]methyl-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (5-bromo-2,3-dioxo-indolin-1-yl)methyl-[2-(tert-butylamino)-2-oxo-ethyl]-methyl-ammonium CAS Name: (5-bromo-2,3-dioxo-1-indolyl)methyl-[2-(tert-butylamino)-2-oxoethyl]-methylammonium IUPAC Name: (5-bromo-2,3-dioxoindol-1-yl)methyl-[2-(tert-butylamino)-2-oxoethyl]-methylazanium Traditional Name: (5-bromo-2,3-diketo-indolin-1-yl)methyl-[2-(tert-butylamino)-2-keto-ethyl]-methyl-ammonium Formula: C16H21BrN3O3+ MolecularWeight: 383.26024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C[NH+](C)CN1C2=C(C=C(C=C2)Br)C(=O)C1=O

Isomeric SMILES

CC(C)(C)NC(=O)C[NH+](C)CN1C2=C(C=C(C=C2)Br)C(=O)C1=O

InChI

InChI=1S/C16H20BrN3O3/c1-16(2,3)18-13(21)8-19(4)9-20-12-6-5-10(17)7-11(12)14(22)15(20)23/h5-7H,8-9H2,1-4H3,(H,18,21)/p+1