6-azanyl-2-[5-(2-nitroimidazol-1-yl)pentyl]benzo[de]isoquinoline-1,3-dione

Systemtic Name: 6-azanyl-2-[5-(2-nitroimidazol-1-yl)pentyl]benzo[de]isoquinoline-1,3-dione Openeye Name: 6-amino-2-[5-(2-nitroimidazol-1-yl)pentyl]benzo[de]isoquinoline-1,3-dione CAS Name: 6-amino-2-[5-(2-nitro-1-imidazolyl)pentyl]benzo[de]isoquinoline-1,3-dione IUPAC Name: 6-amino-2-[5-(2-nitroimidazol-1-yl)pentyl]benzo[de]isoquinoline-1,3-dione Traditional Name: 6-amino-2-[5-(2-nitroimidazol-1-yl)pentyl]benzo[de]isoquinoline-1,3-quinone Formula: C20H19N5O4 MolecularWeight: 393.39596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC3=C2C(=C1)C(=O)N(C3=O)CCCCCN4C=CN=C4[N+](=O)[O-])N

Isomeric SMILES

C1=CC2=C(C=CC3=C2C(=C1)C(=O)N(C3=O)CCCCCN4C=CN=C4[N+](=O)[O-])N

InChI

InChI=1S/C20H19N5O4/c21-16-8-7-15-17-13(16)5-4-6-14(17)18(26)24(19(15)27)11-3-1-2-10-23-12-9-22-20(23)25(28)29/h4-9,12H,1-3,10-11,21H2