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

Systemtic Name: 6-azanyl-2-[3-(2-nitroimidazol-1-yl)propyl]benzo[de]isoquinoline-1,3-dione Openeye Name: 6-amino-2-[3-(2-nitroimidazol-1-yl)propyl]benzo[de]isoquinoline-1,3-dione CAS Name: 6-amino-2-[3-(2-nitro-1-imidazolyl)propyl]benzo[de]isoquinoline-1,3-dione IUPAC Name: 6-amino-2-[3-(2-nitroimidazol-1-yl)propyl]benzo[de]isoquinoline-1,3-dione Traditional Name: 6-amino-2-[3-(2-nitroimidazol-1-yl)propyl]benzo[de]isoquinoline-1,3-quinone Formula: C18H15N5O4 MolecularWeight: 365.3428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC3=C2C(=C1)C(=O)N(C3=O)CCCN4C=CN=C4[N+](=O)[O-])N

Isomeric SMILES

C1=CC2=C(C=CC3=C2C(=C1)C(=O)N(C3=O)CCCN4C=CN=C4[N+](=O)[O-])N

InChI

InChI=1S/C18H15N5O4/c19-14-6-5-13-15-11(14)3-1-4-12(15)16(24)22(17(13)25)9-2-8-21-10-7-20-18(21)23(26)27/h1,3-7,10H,2,8-9,19H2