5-nitro-2-oxidanyl-6-pyrrolidin-1-yl-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 5-nitro-2-oxidanyl-6-pyrrolidin-1-yl-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-hydroxy-5-nitro-6-pyrrolidin-1-yl-benzo[de]isoquinoline-1,3-dione CAS Name: 2-hydroxy-5-nitro-6-(1-pyrrolidinyl)benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-hydroxy-5-nitro-6-pyrrolidin-1-ylbenzo[de]isoquinoline-1,3-dione Traditional Name: 2-hydroxy-5-nitro-6-pyrrolidino-benzo[de]isoquinoline-1,3-quinone Formula: C16H13N3O5 MolecularWeight: 327.29152

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C3C4=C2C=CC=C4C(=O)N(C3=O)O)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C3C4=C2C=CC=C4C(=O)N(C3=O)O)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O5/c20-15-10-5-3-4-9-13(10)11(16(21)18(15)22)8-12(19(23)24)14(9)17-6-1-2-7-17/h3-5,8,22H,1-2,6-7H2