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

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

Systemtic Name:methyl-[[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-[(4-prop-2-enoxyphenyl)methyl]azanium
Openeye Name:(4-allyloxyphenyl)methyl-methyl-[(5-nitro-1,3-dioxo-isoindolin-2-yl)methyl]ammonium
CAS Name:methyl-[(5-nitro-1,3-dioxo-2-isoindolyl)methyl]-[(4-prop-2-enoxyphenyl)methyl]ammonium
IUPAC Name:methyl-[(5-nitro-1,3-dioxoisoindol-2-yl)methyl]-[(4-prop-2-enoxyphenyl)methyl]azanium
Traditional Name:(4-allyloxybenzyl)-[(1,3-diketo-5-nitro-isoindolin-2-yl)methyl]-methyl-ammonium
Formula: C20H20N3O5+
MolecularWeight: 382.3899
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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)OCC=C)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]


Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)OCC=C)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]


InChI

InChI=1S/C20H19N3O5/c1-3-10-28-16-7-4-14(5-8-16)12-21(2)13-22-19(24)17-9-6-15(23(26)27)11-18(17)20(22)25/h3-9,11H,1,10,12-13H2,2H3/p+1


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