[5-bromanyl-2,3-bis(oxidanylidene)indol-1-yl]methyl-methyl-[(4-prop-2-enoxyphenyl)methyl]azanium

Systemtic Name: [5-bromanyl-2,3-bis(oxidanylidene)indol-1-yl]methyl-methyl-[(4-prop-2-enoxyphenyl)methyl]azanium Openeye Name: (4-allyloxyphenyl)methyl-[(5-bromo-2,3-dioxo-indolin-1-yl)methyl]-methyl-ammonium CAS Name: (5-bromo-2,3-dioxo-1-indolyl)methyl-methyl-[(4-prop-2-enoxyphenyl)methyl]ammonium IUPAC Name: (5-bromo-2,3-dioxoindol-1-yl)methyl-methyl-[(4-prop-2-enoxyphenyl)methyl]azanium Traditional Name: (4-allyloxybenzyl)-[(5-bromo-2,3-diketo-indolin-1-yl)methyl]-methyl-ammonium Formula: C20H20BrN2O3+ MolecularWeight: 416.2884

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)OCC=C)CN2C3=C(C=C(C=C3)Br)C(=O)C2=O

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)OCC=C)CN2C3=C(C=C(C=C3)Br)C(=O)C2=O

InChI

InChI=1S/C20H19BrN2O3/c1-3-10-26-16-7-4-14(5-8-16)12-22(2)13-23-18-9-6-15(21)11-17(18)19(24)20(23)25/h3-9,11H,1,10,12-13H2,2H3/p+1