[4-bromanyl-2,3-bis(oxidanylidene)indol-1-yl]methyl-cyclopropyl-[(4-methoxyphenyl)methyl]azanium

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH+](CN2C3=C(C(=CC=C3)Br)C(=O)C2=O)C4CC4

Isomeric SMILES

COC1=CC=C(C=C1)C[NH+](CN2C3=C(C(=CC=C3)Br)C(=O)C2=O)C4CC4

InChI

InChI=1S/C20H19BrN2O3/c1-26-15-9-5-13(6-10-15)11-22(14-7-8-14)12-23-17-4-2-3-16(21)18(17)19(24)20(23)25/h2-6,9-10,14H,7-8,11-12H2,1H3/p+1