2-[2,6-di(propan-2-yl)phenyl]-4-nitro-3H-isoindol-1-one

Systemtic Name: 2-[2,6-di(propan-2-yl)phenyl]-4-nitro-3H-isoindol-1-one Openeye Name: 2-(2,6-diisopropylphenyl)-4-nitro-isoindolin-1-one CAS Name: 2-[2,6-di(propan-2-yl)phenyl]-4-nitro-3H-isoindol-1-one IUPAC Name: 2-[2,6-di(propan-2-yl)phenyl]-4-nitro-3H-isoindol-1-one Traditional Name: 2-(2,6-diisopropylphenyl)-4-nitro-isoindolin-1-one Formula: C20H22N2O3 MolecularWeight: 338.40028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O3/c1-12(2)14-7-5-8-15(13(3)4)19(14)21-11-17-16(20(21)23)9-6-10-18(17)22(24)25/h5-10,12-13H,11H2,1-4H3