2-(3-azanyl-2-oxidanyl-propyl)-4H-isoquinoline-1,3-dione

Systemtic Name: 2-(3-azanyl-2-oxidanyl-propyl)-4H-isoquinoline-1,3-dione Openeye Name: 2-(3-amino-2-hydroxy-propyl)-4H-isoquinoline-1,3-dione CAS Name: 2-(3-amino-2-hydroxypropyl)-4H-isoquinoline-1,3-dione IUPAC Name: 2-(3-amino-2-hydroxypropyl)-4H-isoquinoline-1,3-dione Traditional Name: 2-(3-amino-2-hydroxy-propyl)-4H-isoquinoline-1,3-quinone Formula: C12H14N2O3 MolecularWeight: 234.25116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O3/c13-6-9(15)7-14-11(16)5-8-3-1-2-4-10(8)12(14)17/h1-4,9,15H,5-7,13H2