2-(2,3-dimethylphenyl)-4-nitro-3H-isoindol-1-one

Systemtic Name: 2-(2,3-dimethylphenyl)-4-nitro-3H-isoindol-1-one Openeye Name: 2-(2,3-dimethylphenyl)-4-nitro-isoindolin-1-one CAS Name: 2-(2,3-dimethylphenyl)-4-nitro-3H-isoindol-1-one IUPAC Name: 2-(2,3-dimethylphenyl)-4-nitro-3H-isoindol-1-one Traditional Name: 2-(2,3-dimethylphenyl)-4-nitro-isoindolin-1-one Formula: C16H14N2O3 MolecularWeight: 282.29396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CC3=C(C2=O)C=CC=C3[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CC3=C(C2=O)C=CC=C3[N+](=O)[O-])C

InChI

InChI=1S/C16H14N2O3/c1-10-5-3-7-14(11(10)2)17-9-13-12(16(17)19)6-4-8-15(13)18(20)21/h3-8H,9H2,1-2H3