2-[3-[(3-azanylpyridin-2-yl)-phenyl-amino]propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-[(3-azanylpyridin-2-yl)-phenyl-amino]propyl]isoindole-1,3-dione Openeye Name: 2-[3-(N-(3-amino-2-pyridyl)anilino)propyl]isoindoline-1,3-dione CAS Name: 2-[3-(N-(3-amino-2-pyridinyl)anilino)propyl]isoindole-1,3-dione IUPAC Name: 2-[3-(N-(3-aminopyridin-2-yl)anilino)propyl]isoindole-1,3-dione Traditional Name: 2-[3-(N-(3-amino-2-pyridyl)anilino)propyl]isoindoline-1,3-quinone Formula: C22H20N4O2 MolecularWeight: 372.4198

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCCN2C(=O)C3=CC=CC=C3C2=O)C4=C(C=CC=N4)N

Isomeric SMILES

C1=CC=C(C=C1)N(CCCN2C(=O)C3=CC=CC=C3C2=O)C4=C(C=CC=N4)N

InChI

InChI=1S/C22H20N4O2/c23-19-12-6-13-24-20(19)25(16-8-2-1-3-9-16)14-7-15-26-21(27)17-10-4-5-11-18(17)22(26)28/h1-6,8-13H,7,14-15,23H2