2-(3-azanylpropyl)-4H-isoquinoline-1,3-dione

Systemtic Name: 2-(3-azanylpropyl)-4H-isoquinoline-1,3-dione Openeye Name: 2-(3-aminopropyl)-4H-isoquinoline-1,3-dione CAS Name: 2-(3-aminopropyl)-4H-isoquinoline-1,3-dione IUPAC Name: 2-(3-aminopropyl)-4H-isoquinoline-1,3-dione Traditional Name: 2-(3-aminopropyl)-4H-isoquinoline-1,3-quinone Formula: C12H14N2O2 MolecularWeight: 218.25176

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)N(C1=O)CCCN

Isomeric SMILES

C1C2=CC=CC=C2C(=O)N(C1=O)CCCN

InChI

InChI=1S/C12H14N2O2/c13-6-3-7-14-11(15)8-9-4-1-2-5-10(9)12(14)16/h1-2,4-5H,3,6-8,13H2