2-[3,5-dideuterio-4-(1-deuterioethyl)phenyl]-3H-isoindol-1-one

Systemtic Name: 2-[3,5-dideuterio-4-(1-deuterioethyl)phenyl]-3H-isoindol-1-one Openeye Name: 2-[3,5-dideuterio-4-(1-deuterioethyl)phenyl]isoindolin-1-one CAS Name: 2-[3,5-dideuterio-4-(1-deuterioethyl)phenyl]-3H-isoindol-1-one IUPAC Name: 2-[3,5-dideuterio-4-(1-deuterioethyl)phenyl]-3H-isoindol-1-one Traditional Name: 2-[3,5-dideuterio-4-(1-deuterioethyl)phenyl]isoindolin-1-one Formula: C16H15NO MolecularWeight: 240.314885

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2CC3=CC=CC=C3C2=O

Isomeric SMILES

[2H]C1=CC(=CC(=C1C([2H])C)[2H])N2CC3=CC=CC=C3C2=O

InChI

InChI=1S/C16H15NO/c1-2-12-7-9-14(10-8-12)17-11-13-5-3-4-6-15(13)16(17)18/h3-10H,2,11H2,1H3/i2D,7D,8D