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5-nitro-2-[(4-propan-2-ylphenyl)methyl]isoindole-1,3-dione

5-nitro-2-[(4-propan-2-ylphenyl)methyl]isoindole-1,3-dione

Systemtic Name:5-nitro-2-[(4-propan-2-ylphenyl)methyl]isoindole-1,3-dione
Openeye Name:2-[(4-isopropylphenyl)methyl]-5-nitro-isoindoline-1,3-dione
CAS Name:5-nitro-2-[(4-propan-2-ylphenyl)methyl]isoindole-1,3-dione
IUPAC Name:5-nitro-2-[(4-propan-2-ylphenyl)methyl]isoindole-1,3-dione
Traditional Name:2-(4-isopropylbenzyl)-5-nitro-isoindoline-1,3-quinone
Formula: C18H16N2O4
MolecularWeight: 324.33064
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C18H16N2O4/c1-11(2)13-5-3-12(4-6-13)10-19-17(21)15-8-7-14(20(23)24)9-16(15)18(19)22/h3-9,11H,10H2,1-2H3


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