2-[(2S)-2-azido-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propyl]isoindole-1,3-dione

Systemtic Name: 2-[(2S)-2-azido-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propyl]isoindole-1,3-dione Openeye Name: 2-[(2S)-2-azido-3-(4-tert-butoxyphenyl)propyl]isoindoline-1,3-dione CAS Name: 2-[(2S)-2-azido-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propyl]isoindole-1,3-dione IUPAC Name: 2-[(2S)-2-azido-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propyl]isoindole-1,3-dione Traditional Name: 2-[(2S)-2-azido-3-(4-tert-butoxyphenyl)propyl]isoindoline-1,3-quinone Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC1=CC=C(C=C1)CC(CN2C(=O)C3=CC=CC=C3C2=O)N=[N+]=[N-]

Isomeric SMILES

CC(C)(C)OC1=CC=C(C=C1)C[C@@H](CN2C(=O)C3=CC=CC=C3C2=O)N=[N+]=[N-]

InChI

InChI=1S/C21H22N4O3/c1-21(2,3)28-16-10-8-14(9-11-16)12-15(23-24-22)13-25-19(26)17-6-4-5-7-18(17)20(25)27/h4-11,15H,12-13H2,1-3H3/t15-/m0/s1